data_1pco_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 1pco _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 10' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 . . . . . 0 CA--C 1.579 2.093 0 N-CA-C 116.96 2.207 . . . . 0.0 116.96 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mt -132.42 152.51 51.46 Favored 'General case' 0 N--CA 1.5 2.068 0 CA-C-O 123.695 1.712 . . . . 0.0 113.269 173.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -83.81 163.51 20.1 Favored 'General case' 0 CA--C 1.571 1.752 0 CA-C-N 114.375 -1.284 . . . . 0.0 113.612 177.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.77 137.79 38.64 Favored 'General case' 0 CA--C 1.579 2.062 0 O-C-N 120.867 -1.146 . . . . 0.0 108.011 172.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.33 1.22 44.19 Favored Glycine 0 CA--C 1.56 2.889 0 N-CA-C 115.866 1.106 . . . . 0.0 115.866 -171.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -113.34 149.81 33.48 Favored 'General case' 0 CA--C 1.572 1.807 0 CA-C-N 118.951 1.375 . . . . 0.0 110.283 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.4 tt -69.45 128.12 35.42 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 120.824 -1.172 . . . . 0.0 112.87 -176.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.9 p -128.97 151.78 49.31 Favored 'General case' 0 CA--C 1.562 1.404 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -177.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.9 mt -85.84 -81.5 0.21 Allowed 'General case' 0 CA--C 1.567 1.6 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 173.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -94.53 177.76 5.82 Favored 'General case' 0 N--CA 1.499 1.981 0 CA-C-N 119.311 0.959 . . . . 0.0 112.57 173.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -71.0 -6.19 36.99 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 173.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.31 7.18 4.56 Favored 'General case' 0 CA--C 1.571 1.771 0 N-CA-C 117.128 2.27 . . . . 0.0 117.128 172.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -91.72 -51.2 5.35 Favored 'General case' 0 CA--C 1.567 1.607 0 C-N-CA 124.116 0.966 . . . . 0.0 111.97 -177.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 80.0 m -82.6 147.69 28.44 Favored 'General case' 0 CA--C 1.558 1.267 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -53.56 -53.7 47.98 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 124.039 0.936 . . . . 0.0 111.082 173.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 65.3 m -83.27 104.31 13.33 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 103.568 -2.753 . . . . 0.0 103.568 168.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.87 80.42 0.46 Allowed 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 124.998 2.332 . . . . 0.0 114.624 -172.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.0 t -142.54 72.97 1.39 Allowed 'General case' 0 CA--C 1.56 1.352 0 CA-C-N 112.291 -2.231 . . . . 0.0 110.076 -174.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 34.6 t -78.74 111.38 14.8 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 104.746 -2.316 . . . . 0.0 104.746 172.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -100.42 115.62 30.45 Favored 'General case' 0 CA--C 1.567 1.627 0 CA-C-O 122.997 1.38 . . . . 0.0 114.332 -170.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -82.19 158.22 23.67 Favored 'General case' 0 CA--C 1.566 1.583 0 C-N-CA 126.047 1.739 . . . . 0.0 113.238 -178.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.3 -55.56 32.19 Favored 'General case' 0 CA--C 1.583 2.228 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 174.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.6 t 175.29 -38.88 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.518 0 C-N-CA 125.794 1.638 . . . . 0.0 111.838 -174.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 6.0 tp -157.28 -46.33 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.225 0 CA-C-N 119.95 1.25 . . . . 0.0 113.272 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.6 mt -77.07 -83.44 0.07 Allowed 'General case' 0 N--CA 1.497 1.888 0 CA-C-N 120.708 1.595 . . . . 0.0 112.91 -174.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 96.3 p -154.89 -123.65 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 121.332 1.878 . . . . 0.0 112.934 174.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.1 tt 53.96 80.72 0.11 Allowed 'General case' 0 N--CA 1.503 2.181 0 CA-C-N 120.325 1.42 . . . . 0.0 110.944 -173.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.5 m -117.06 107.65 14.78 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 122.947 1.356 . . . . 0.0 111.262 -174.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 20.7 ttp180 -125.93 141.37 52.01 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.682 1.193 . . . . 0.0 108.616 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 91.1 m -67.08 147.61 52.94 Favored 'General case' 0 CA--C 1.561 1.394 0 O-C-N 119.656 -1.903 . . . . 0.0 114.586 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.14 -177.82 5.18 Favored 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 113.262 -1.79 . . . . 0.0 112.303 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 35.5 tp -85.68 142.95 28.67 Favored 'General case' 0 CA--C 1.571 1.756 0 O-C-N 120.987 -1.071 . . . . 0.0 112.66 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -72.42 143.96 48.33 Favored 'General case' 0 CA--C 1.575 1.937 0 O-C-N 121.497 -0.752 . . . . 0.0 110.186 173.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.26 152.18 36.57 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 118.611 2.819 . . . . 0.0 118.611 -171.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.9 mmt180 -121.48 175.74 6.04 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-N 111.522 -2.581 . . . . 0.0 111.732 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -57.84 127.56 32.67 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -173.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 76.39 29.59 0.7 Allowed 'General case' 0 N--CA 1.504 2.268 0 C-N-CA 125.194 1.398 . . . . 0.0 113.593 -172.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.6 t -124.85 149.6 47.31 Favored 'General case' 0 CA--C 1.566 1.581 0 O-C-N 120.485 -1.385 . . . . 0.0 112.123 175.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -77.85 104.76 8.6 Favored 'General case' 0 CA--C 1.572 1.791 0 CA-C-O 123.533 1.635 . . . . 0.0 113.207 -177.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -101.22 167.58 10.11 Favored 'General case' 0 CA--C 1.575 1.911 0 C-N-CA 125.901 1.68 . . . . 0.0 111.794 173.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.0 t -86.51 -86.7 0.14 Allowed 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 104.984 -2.228 . . . . 0.0 104.984 170.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -156.34 -74.51 0.1 Allowed 'General case' 0 CA--C 1.565 1.557 0 CA-C-N 120.513 1.506 . . . . 0.0 112.606 172.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 23.3 p90 -137.58 177.53 7.8 Favored 'General case' 0 CA--C 1.574 1.875 0 C-N-CA 124.013 0.925 . . . . 0.0 111.548 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.1 p -87.89 135.22 33.49 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.599 -1.313 . . . . 0.0 113.634 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -100.98 -121.49 0.16 Allowed 'General case' 0 CA--C 1.566 1.563 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 172.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -144.64 74.36 1.41 Allowed 'General case' 0 CA--C 1.57 1.732 0 N-CA-C 103.663 -2.717 . . . . 0.0 103.663 171.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 168.2 -171.57 42.54 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 116.217 1.247 . . . . 0.0 116.217 -174.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.4 t -77.65 142.29 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 CA-C-O 122.779 1.276 . . . . 0.0 111.103 -172.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -115.37 126.55 54.55 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.075 -172.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -59.61 -40.99 89.37 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 175.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -142.49 113.24 7.42 Favored 'General case' 0 CA--C 1.56 1.365 0 N-CA-C 102.891 -3.003 . . . . 0.0 102.891 171.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 59.0 m -52.02 144.14 21.61 Favored Pre-proline 0 CA--C 1.586 2.358 0 N-CA-C 115.796 1.776 . . . . 0.0 115.796 -177.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -68.26 179.62 2.81 Favored 'Trans proline' 0 CA--C 1.568 2.187 0 C-N-CA 122.284 1.989 . . . . 0.0 116.411 -174.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 56.7 m -74.06 149.03 41.4 Favored 'General case' 0 CA--C 1.573 1.84 0 O-C-N 121.029 -1.044 . . . . 0.0 112.682 174.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.51 176.51 2.85 Favored 'General case' 0 CA--C 1.583 2.233 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 177.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.4 113.66 4.26 Favored 'General case' 0 CA--C 1.579 2.062 0 O-C-N 119.866 -1.771 . . . . 0.0 112.983 178.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 122.49 -39.11 2.36 Favored Glycine 0 N--CA 1.497 2.737 0 CA-C-N 113.923 -1.49 . . . . 0.0 116.079 -173.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 mp -98.4 151.77 20.2 Favored 'General case' 0 CA--C 1.567 1.604 0 CA-C-O 122.732 1.253 . . . . 0.0 112.704 -177.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -111.23 151.83 27.82 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.158 -0.964 . . . . 0.0 111.407 -179.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 4.0 t -90.65 117.76 29.56 Favored 'General case' 0 CA--C 1.569 1.685 0 C-N-CA 122.827 0.451 . . . . 0.0 111.991 175.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 . . . . . 0 N--CA 1.496 1.839 0 O-C-N 120.617 -1.302 . . . . 0.0 109.86 -176.715 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 123.3 1.524 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -153.71 168.25 32.21 Favored Glycine 0 N--CA 1.48 1.59 0 CA-C-N 115.246 -0.888 . . . . 0.0 114.735 -175.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 23.8 mm -97.9 132.43 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.15 -1.206 . . . . 0.0 109.577 -176.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.2 m -67.12 125.83 27.25 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 174.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -143.23 158.95 43.17 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 123.105 1.431 . . . . 0.0 111.832 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -93.81 74.66 4.25 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 123.54 1.638 . . . . 0.0 111.511 -174.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 N--CA 1.504 2.253 0 CA-C-N 113.693 -1.594 . . . . 0.0 115.048 -176.782 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.576 1.973 0 N-CA-C 116.959 2.207 . . . . 0.0 116.959 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.2 tp -159.39 125.15 4.29 Favored 'General case' 0 CA--C 1.579 2.091 0 N-CA-C 105.744 -1.947 . . . . 0.0 105.744 173.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -80.44 165.52 22.12 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 118.874 -2.391 . . . . 0.0 113.486 -175.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.17 144.01 44.99 Favored 'General case' 0 CA--C 1.576 1.974 0 O-C-N 120.962 -1.086 . . . . 0.0 110.037 174.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.79 25.06 26.1 Favored Glycine 0 CA--C 1.563 3.042 0 N-CA-C 114.769 0.668 . . . . 0.0 114.769 -171.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -136.15 148.4 48.18 Favored 'General case' 0 CA--C 1.571 1.762 0 C-N-CA 125.462 1.505 . . . . 0.0 109.132 -178.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 tt -69.1 117.75 11.14 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.59 -1.319 . . . . 0.0 112.284 -176.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 26.5 p -117.42 152.88 34.08 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 121.797 0.808 . . . . 0.0 113.054 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.0 mp -89.87 -78.72 0.36 Allowed 'General case' 0 CA--C 1.568 1.64 0 N-CA-C 106.348 -1.723 . . . . 0.0 106.348 172.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -96.46 168.86 10.29 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 120.59 1.541 . . . . 0.0 114.512 174.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.5 t -70.25 -21.93 62.93 Favored 'General case' 0 N--CA 1.506 2.355 0 N-CA-C 116.332 1.975 . . . . 0.0 116.332 174.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.17 16.74 0.54 Allowed 'General case' 0 CA--C 1.575 1.919 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 174.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 67.7 mt-30 -104.29 -39.66 6.4 Favored 'General case' 0 CA--C 1.572 1.813 0 C-N-CA 125.005 1.322 . . . . 0.0 113.177 173.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.0 m -80.7 149.04 29.9 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 115.54 1.682 . . . . 0.0 115.54 -177.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -57.02 -54.55 45.44 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.114 0.966 . . . . 0.0 110.544 172.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 91.9 p -82.42 101.28 10.54 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 103.766 -2.679 . . . . 0.0 103.766 168.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -69.39 80.47 0.38 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 125.267 2.46 . . . . 0.0 113.89 -172.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.2 t -156.93 82.41 0.94 Allowed 'General case' 0 CA--C 1.56 1.354 0 CA-C-N 112.096 -2.32 . . . . 0.0 110.729 -173.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 29.7 t -81.5 109.08 15.63 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 105.418 -2.068 . . . . 0.0 105.418 172.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.58 123.29 34.11 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-O 122.453 1.12 . . . . 0.0 112.726 -172.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -82.02 149.04 28.31 Favored 'General case' 0 CA--C 1.559 1.296 0 CA-C-O 122.707 1.241 . . . . 0.0 113.732 -178.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -65.92 -1.26 2.84 Favored 'General case' 0 CA--C 1.585 2.317 0 N-CA-C 116.279 1.955 . . . . 0.0 116.279 171.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.266 64.9 p 68.84 85.75 0.14 Allowed 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 127.192 2.197 . . . . 0.0 110.384 -178.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.276 5.3 mp 77.41 140.78 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.587 2.379 0 C-N-CA 125.426 1.49 . . . . 0.0 109.364 -173.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.309 10.0 tp 84.94 -138.24 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.103 0 C-N-CA 126.455 1.902 . . . . 0.0 109.19 -174.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 96.4 p -165.3 96.61 0.69 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 121.445 1.929 . . . . 0.0 114.218 178.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 54.6 tp -150.35 89.25 1.56 Allowed 'General case' 0 CA--C 1.564 1.503 0 N-CA-C 103.925 -2.62 . . . . 0.0 103.925 173.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.8 m -104.51 132.85 50.28 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 122.832 1.301 . . . . 0.0 113.394 -172.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -136.93 133.56 35.82 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.528 1.131 . . . . 0.0 108.822 -177.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 55.2 m -66.57 146.46 54.48 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 124.341 2.019 . . . . 0.0 113.703 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -138.25 -178.08 5.12 Favored 'General case' 0 CA--C 1.564 1.483 0 CA-C-N 112.615 -2.084 . . . . 0.0 112.338 -174.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.5 tp -83.83 125.09 31.62 Favored 'General case' 0 CA--C 1.569 1.706 0 O-C-N 121.313 -0.867 . . . . 0.0 111.05 174.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -61.02 148.5 39.98 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 123.891 0.876 . . . . 0.0 112.508 174.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.21 152.53 42.17 Favored 'General case' 0 CA--C 1.564 1.517 0 N-CA-C 118.529 2.788 . . . . 0.0 118.529 -170.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.63 168.09 9.31 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 112.82 -1.991 . . . . 0.0 111.45 -174.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -51.59 139.42 20.57 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -178.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.354 10.9 p30 57.75 28.9 16.57 Favored 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -172.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.9 m -129.43 153.1 48.27 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-O 122.691 1.234 . . . . 0.0 110.55 174.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -69.5 137.27 52.4 Favored 'General case' 0 CA--C 1.578 2.044 0 CA-C-O 124.631 2.158 . . . . 0.0 115.354 -175.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 27.3 p -142.0 147.59 37.16 Favored 'General case' 0 CA--C 1.566 1.592 0 CA-C-N 112.241 -2.254 . . . . 0.0 110.691 -178.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 60.2 m -77.62 104.48 8.18 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 119.707 -1.871 . . . . 0.0 108.025 174.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.85 43.93 0.52 Allowed 'General case' 0 CA--C 1.573 1.855 0 N-CA-C 118.732 2.864 . . . . 0.0 118.732 -173.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.9 p90 -164.29 138.01 5.3 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 126.096 1.758 . . . . 0.0 107.834 -174.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.5 p -114.21 137.68 51.46 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-O 122.883 1.325 . . . . 0.0 109.96 174.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.275 2.1 pp -96.22 -78.74 0.46 Allowed 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 113.821 -1.536 . . . . 0.0 108.48 176.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -159.84 -14.67 0.06 Allowed 'General case' 0 CA--C 1.587 2.378 0 C-N-CA 125.584 1.554 . . . . 0.0 112.757 176.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -164.59 -93.05 0.09 OUTLIER Glycine 0 N--CA 1.478 1.496 0 O-C-N 120.127 -1.608 . . . . 0.0 115.87 -174.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 1.9 t -79.28 143.94 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.191 0 CA-C-N 119.18 1.49 . . . . 0.0 112.243 -164.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -126.86 144.05 51.09 Favored 'General case' 0 CA--C 1.56 1.346 0 N-CA-C 114.96 1.466 . . . . 0.0 114.96 -172.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -69.65 -44.65 70.14 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.832 173.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -139.13 115.86 10.74 Favored 'General case' 0 CA--C 1.565 1.553 0 N-CA-C 102.783 -3.043 . . . . 0.0 102.783 173.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 58.2 m -53.5 145.71 27.16 Favored Pre-proline 0 CA--C 1.591 2.548 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 -174.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -79.0 65.57 8.85 Favored 'Trans proline' 0 CA--C 1.571 2.372 0 C-N-CA 123.498 2.799 . . . . 0.0 117.42 -173.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 58.1 m 58.97 165.17 0.05 OUTLIER 'General case' 0 CA--C 1.579 2.086 0 N-CA-C 117.048 2.24 . . . . 0.0 117.048 176.221 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -72.61 149.71 43.7 Favored 'General case' 0 CA--C 1.567 1.627 0 O-C-N 120.818 -1.176 . . . . 0.0 112.978 174.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.73 103.98 0.98 Allowed 'General case' 0 N--CA 1.499 2.003 0 CA-C-O 122.83 1.3 . . . . 0.0 112.368 -174.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 131.09 -32.01 3.07 Favored Glycine 0 CA--C 1.558 2.774 0 CA-C-N 114.344 -1.298 . . . . 0.0 114.58 -171.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mp -96.77 151.5 19.58 Favored 'General case' 0 CA--C 1.566 1.59 0 CA-C-O 122.77 1.271 . . . . 0.0 111.456 172.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -99.36 154.53 18.12 Favored 'General case' 0 CA--C 1.562 1.404 0 CA-C-O 122.291 1.043 . . . . 0.0 112.142 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 17.2 t -93.71 118.43 31.4 Favored 'General case' 0 CA--C 1.569 1.68 0 CA-C-N 115.327 -0.851 . . . . 0.0 108.79 172.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 . . . . . 0 CA--C 1.57 1.732 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -172.667 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 99.5 m-85 . . . . . 0 CA--C 1.573 1.861 0 CA-C-O 121.959 0.885 . . . . 0.0 111.816 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -55.96 154.11 14.81 Favored Glycine 0 N--CA 1.499 2.87 0 N-CA-C 117.712 1.845 . . . . 0.0 117.712 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 42.6 mm -99.8 137.13 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 O-C-N 120.668 -1.489 . . . . 0.0 110.804 -172.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 67.3 m -68.72 124.25 23.14 Favored 'General case' 0 CA--C 1.572 1.814 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 174.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 69.9 m-70 -141.47 163.11 33.82 Favored 'General case' 0 CA--C 1.565 1.539 0 O-C-N 120.628 -1.295 . . . . 0.0 111.048 178.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -95.82 85.45 4.11 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 123.483 1.611 . . . . 0.0 111.981 -175.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 48.0 t . . . . . 0 N--CA 1.497 1.903 0 CA-C-N 113.535 -1.666 . . . . 0.0 106.862 177.046 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.304 1.0 OUTLIER . . . . . 0 N--CA 1.507 2.39 0 N-CA-C 118.918 2.933 . . . . 0.0 118.918 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.1 mp -99.01 123.07 43.05 Favored 'General case' 0 CA--C 1.567 1.625 0 CA-C-O 122.778 1.275 . . . . 0.0 112.052 175.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -84.78 169.92 13.73 Favored 'General case' 0 CA--C 1.574 1.892 0 O-C-N 121.129 -0.982 . . . . 0.0 111.087 172.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.77 123.58 17.44 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.621 -1.3 . . . . 0.0 111.471 175.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 111.12 -6.2 28.83 Favored Glycine 0 CA--C 1.559 2.804 0 N-CA-C 117.157 1.623 . . . . 0.0 117.157 -172.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -99.09 135.73 40.08 Favored 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 119.635 1.718 . . . . 0.0 111.857 -178.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.6 tt -76.04 128.04 34.2 Favored 'General case' 0 CA--C 1.575 1.924 0 O-C-N 121.46 -0.775 . . . . 0.0 112.183 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.6 p -120.7 -171.78 2.25 Favored 'General case' 0 CA--C 1.577 1.998 0 CA-C-O 123.206 1.479 . . . . 0.0 114.702 -174.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.6 mt -112.29 -75.92 0.6 Allowed 'General case' 0 CA--C 1.578 2.025 0 N-CA-C 103.815 -2.661 . . . . 0.0 103.815 169.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.1 p30 -93.91 -177.67 4.41 Favored 'General case' 0 CA--C 1.589 2.47 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 172.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.0 m -84.95 -17.66 36.99 Favored 'General case' 0 N--CA 1.508 2.428 0 N-CA-C 116.289 1.959 . . . . 0.0 116.289 173.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.25 7.4 2.82 Favored 'General case' 0 CA--C 1.583 2.241 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 173.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -94.4 -40.78 9.75 Favored 'General case' 0 CA--C 1.568 1.66 0 C-N-CA 126.17 1.788 . . . . 0.0 110.862 173.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.7 m -76.24 117.18 17.66 Favored 'General case' 0 CA--C 1.566 1.586 0 CA-C-N 119.449 1.022 . . . . 0.0 109.604 173.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -77.63 9.56 3.3 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 118.007 2.595 . . . . 0.0 118.007 -174.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 65.0 p -81.15 -88.32 0.08 Allowed 'General case' 0 CA--C 1.581 2.152 0 N-CA-C 104.346 -2.464 . . . . 0.0 104.346 169.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -171.41 25.71 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.167 0 C-N-CA 125.996 1.718 . . . . 0.0 111.056 171.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 5.9 t -161.51 120.57 2.46 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 119.003 2.964 . . . . 0.0 119.003 -170.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 35.4 t -103.4 119.99 39.94 Favored 'General case' 0 CA--C 1.56 1.352 0 N-CA-C 102.651 -3.092 . . . . 0.0 102.651 167.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -93.31 115.37 27.95 Favored 'General case' 0 CA--C 1.562 1.425 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 -172.191 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -84.04 114.6 21.85 Favored 'General case' 0 CA--C 1.567 1.596 0 C-N-CA 124.55 1.14 . . . . 0.0 112.228 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -82.78 89.75 6.82 Favored 'General case' 0 CA--C 1.571 1.768 0 O-C-N 119.927 -1.733 . . . . 0.0 111.439 174.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.305 5.6 t 52.6 -177.0 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -176.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 28.5 mm -57.65 -28.78 32.91 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.607 0 O-C-N 118.937 -2.352 . . . . 0.0 114.812 -179.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.6 mt -51.98 -21.91 3.5 Favored 'General case' 0 N--CA 1.503 2.177 0 N-CA-C 118.544 2.794 . . . . 0.0 118.544 174.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.406 39.2 p 100.19 -122.65 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 127.67 2.388 . . . . 0.0 112.187 174.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 31.0 tp 45.48 76.84 0.09 Allowed 'General case' 0 N--CA 1.504 2.233 0 CA-C-N 120.426 1.466 . . . . 0.0 112.978 -173.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 48.6 m -98.14 108.23 20.89 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-O 122.023 0.916 . . . . 0.0 112.51 -172.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 34.2 ttm105 -118.17 136.55 53.56 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 124.091 0.956 . . . . 0.0 110.331 -176.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 62.6 m -62.92 154.21 31.01 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 117.59 2.441 . . . . 0.0 117.59 -174.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.95 -175.8 4.36 Favored 'General case' 0 CA--C 1.572 1.791 0 CA-C-N 112.713 -2.04 . . . . 0.0 112.443 -177.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.8 tp -116.88 171.88 7.61 Favored 'General case' 0 CA--C 1.572 1.821 0 O-C-N 121.204 -0.935 . . . . 0.0 110.929 176.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -56.32 145.35 27.27 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.814 -1.179 . . . . 0.0 113.706 174.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.1 149.62 35.7 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-O 123.928 1.823 . . . . 0.0 115.267 -174.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 44.4 mtp180 -107.68 169.19 8.74 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-N 112.715 -2.039 . . . . 0.0 111.731 -178.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -51.18 125.52 14.19 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -174.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 77.84 7.76 2.6 Favored 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -173.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.0 t -102.46 157.25 17.05 Favored 'General case' 0 CA--C 1.564 1.498 0 CA-C-O 123.104 1.431 . . . . 0.0 112.472 174.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -76.96 107.11 9.07 Favored 'General case' 0 CA--C 1.567 1.629 0 CA-C-O 123.218 1.485 . . . . 0.0 114.477 -173.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 23.1 p -114.96 147.61 39.81 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 113.373 -1.739 . . . . 0.0 113.237 176.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.0 t -104.8 130.82 52.83 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 170.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.85 -39.11 66.79 Favored 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 176.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -95.01 160.13 14.71 Favored 'General case' 0 CA--C 1.574 1.871 0 C-N-CA 125.541 1.536 . . . . 0.0 110.18 172.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 35.7 p -128.98 152.32 48.72 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-O 123.592 1.663 . . . . 0.0 110.434 173.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -97.38 -59.35 1.8 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 114.133 -1.394 . . . . 0.0 112.187 175.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -164.68 -52.31 0.03 OUTLIER 'General case' 0 CA--C 1.572 1.804 0 C-N-CA 126.195 1.798 . . . . 0.0 109.476 -176.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 100.69 102.4 2.52 Favored Glycine 0 CA--C 1.542 1.756 0 CA-C-O 122.754 1.197 . . . . 0.0 114.749 -177.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 13.8 t -103.58 141.33 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.123 0 O-C-N 118.09 -3.006 . . . . 0.0 107.704 83.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -113.4 133.91 54.92 Favored 'General case' 0 CA--C 1.553 1.058 0 N-CA-C 116.691 2.108 . . . . 0.0 116.691 -171.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -85.3 6.1 27.71 Favored 'General case' 0 CA--C 1.595 2.694 0 CA-C-N 115.04 -0.982 . . . . 0.0 113.482 169.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.85 102.95 0.79 Allowed 'General case' 0 CA--C 1.57 1.745 0 C-N-CA 127.563 2.345 . . . . 0.0 107.104 -171.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 95.6 m -67.56 131.95 92.92 Favored Pre-proline 0 CA--C 1.581 2.161 0 O-C-N 118.827 -2.42 . . . . 0.0 113.216 175.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -48.95 152.1 4.99 Favored 'Trans proline' 0 CA--C 1.569 2.227 0 C-N-CA 122.949 2.433 . . . . 0.0 116.68 175.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 1.8 t -74.25 150.68 40.14 Favored 'General case' 0 CA--C 1.572 1.826 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -173.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -67.76 162.38 24.0 Favored 'General case' 0 CA--C 1.574 1.886 0 N-CA-C 115.872 1.804 . . . . 0.0 115.872 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -64.25 119.05 9.54 Favored 'General case' 0 CA--C 1.572 1.808 0 O-C-N 120.735 -1.228 . . . . 0.0 111.754 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.91 -32.2 6.72 Favored Glycine 0 N--CA 1.494 2.56 0 CA-C-N 114.687 -1.142 . . . . 0.0 115.738 -172.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.6 mp -99.4 143.19 29.94 Favored 'General case' 0 CA--C 1.563 1.473 0 CA-C-O 122.798 1.285 . . . . 0.0 111.251 176.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.7 150.13 21.53 Favored 'General case' 0 CA--C 1.561 1.37 0 CA-C-O 122.449 1.118 . . . . 0.0 111.428 179.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 7.7 t -97.06 114.84 26.52 Favored 'General case' 0 CA--C 1.567 1.606 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.579 173.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 . . . . . 0 N--CA 1.498 1.942 0 O-C-N 120.476 -1.39 . . . . 0.0 109.835 177.218 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 . . . . . 0 CA--C 1.572 1.812 0 CA-C-O 121.772 0.796 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -141.84 -174.79 14.8 Favored Glycine 0 N--CA 1.493 2.466 0 O-C-N 119.778 -1.826 . . . . 0.0 116.822 176.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.6 mm -126.49 142.95 41.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 CA-C-O 122.101 0.953 . . . . 0.0 110.081 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 8.0 m -73.83 127.77 33.73 Favored 'General case' 0 CA--C 1.569 1.71 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 173.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 72.3 m-70 -140.52 155.86 46.5 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.824 -1.172 . . . . 0.0 109.623 174.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -92.41 81.14 4.89 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 119.528 -1.982 . . . . 0.0 113.064 -173.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 72.5 t . . . . . 0 N--CA 1.502 2.163 0 CA-C-N 112.685 -2.052 . . . . 0.0 112.865 -179.411 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 . . . . . 0 N--CA 1.507 2.387 0 N-CA-C 116.135 1.902 . . . . 0.0 116.135 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 36.7 tp -115.15 123.5 49.09 Favored 'General case' 0 CA--C 1.576 1.964 0 O-C-N 120.578 -1.327 . . . . 0.0 111.649 -177.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -66.1 162.81 18.83 Favored 'General case' 0 CA--C 1.576 1.976 0 O-C-N 119.757 -1.84 . . . . 0.0 115.624 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.31 130.38 44.24 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-O 121.928 0.87 . . . . 0.0 111.123 174.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 116.74 -13.8 14.8 Favored Glycine 0 CA--C 1.557 2.711 0 N-CA-C 116.844 1.498 . . . . 0.0 116.844 -172.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -103.98 151.15 23.54 Favored 'General case' 0 CA--C 1.567 1.627 0 CA-C-N 119.123 1.461 . . . . 0.0 112.716 -176.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.0 tt -73.33 123.43 23.76 Favored 'General case' 0 CA--C 1.574 1.888 0 O-C-N 121.308 -0.87 . . . . 0.0 112.095 -178.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.4 p -123.57 155.13 38.22 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 -176.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 mp -89.22 -76.67 0.4 Allowed 'General case' 0 CA--C 1.568 1.666 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 174.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -95.68 170.06 9.59 Favored 'General case' 0 CA--C 1.576 1.965 0 N-CA-C 114.414 1.264 . . . . 0.0 114.414 173.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 66.8 m -76.87 -21.58 54.74 Favored 'General case' 0 N--CA 1.507 2.381 0 N-CA-C 117.244 2.313 . . . . 0.0 117.244 176.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.79 7.26 3.23 Favored 'General case' 0 CA--C 1.583 2.229 0 N-CA-C 116.813 2.153 . . . . 0.0 116.813 174.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -96.2 -24.88 16.04 Favored 'General case' 0 CA--C 1.57 1.716 0 N-CA-C 115.662 1.727 . . . . 0.0 115.662 176.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 18.6 m -78.27 171.69 14.69 Favored 'General case' 0 CA--C 1.58 2.131 0 CA-C-N 121.029 1.74 . . . . 0.0 114.161 177.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -68.41 -65.37 0.71 Allowed 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.516 -1.365 . . . . 0.0 108.234 172.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 57.7 m -83.28 109.36 17.19 Favored 'General case' 0 CA--C 1.565 1.537 0 N-CA-C 101.157 -3.645 . . . . 0.0 101.157 168.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -67.66 82.36 0.18 Allowed 'General case' 0 N--CA 1.503 2.201 0 CA-C-O 125.158 2.409 . . . . 0.0 114.833 -171.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.8 t -145.25 77.39 1.52 Allowed 'General case' 0 CA--C 1.562 1.415 0 CA-C-N 111.549 -2.569 . . . . 0.0 112.482 -172.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.9 t -79.38 117.41 20.34 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 103.862 -2.644 . . . . 0.0 103.862 171.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.39 111.18 23.49 Favored 'General case' 0 CA--C 1.566 1.588 0 CA-C-O 123.256 1.503 . . . . 0.0 114.726 -169.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -85.56 172.1 11.21 Favored 'General case' 0 CA--C 1.572 1.803 0 C-N-CA 126.514 1.926 . . . . 0.0 111.82 174.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -76.1 -62.91 1.44 Allowed 'General case' 0 CA--C 1.588 2.407 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 169.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.6 p -147.26 -92.45 0.09 Allowed 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 102.329 -3.211 . . . . 0.0 102.329 172.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 92.3 mt -119.07 -12.13 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.567 0 CA-C-N 121.661 2.028 . . . . 0.0 113.318 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.9 tp -127.3 94.71 4.07 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 122.652 2.478 . . . . 0.0 112.214 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.7 p -172.43 164.7 5.71 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 124.473 1.109 . . . . 0.0 112.949 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 15.6 tp -75.56 121.45 22.42 Favored 'General case' 0 CA--C 1.574 1.892 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 171.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.4 m -95.69 138.89 32.71 Favored 'General case' 0 CA--C 1.569 1.693 0 O-C-N 121.246 -0.909 . . . . 0.0 113.304 -172.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 18.5 ttp180 -132.64 144.07 50.09 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.377 -0.827 . . . . 0.0 111.831 -175.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 71.6 m -63.76 138.4 58.47 Favored 'General case' 0 CA--C 1.566 1.574 0 O-C-N 119.676 -1.89 . . . . 0.0 113.302 175.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -138.88 -172.14 3.25 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-N 113.937 -1.483 . . . . 0.0 113.243 -173.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.5 mt -89.2 151.14 22.33 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-O 122.261 1.029 . . . . 0.0 112.74 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.15 152.66 36.64 Favored 'General case' 0 CA--C 1.572 1.825 0 O-C-N 121.619 -0.676 . . . . 0.0 112.525 173.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.93 171.14 15.51 Favored 'General case' 0 CA--C 1.573 1.833 0 CA-C-O 123.435 1.588 . . . . 0.0 114.186 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -118.83 164.97 14.62 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 122.897 1.332 . . . . 0.0 112.304 -174.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -61.24 137.77 58.23 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.299 -0.875 . . . . 0.0 113.209 178.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 64.58 26.37 13.27 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -173.096 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 52.4 m -123.01 149.62 44.09 Favored 'General case' 0 CA--C 1.561 1.378 0 CA-C-O 122.929 1.347 . . . . 0.0 110.186 174.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -75.63 102.13 5.22 Favored 'General case' 0 CA--C 1.576 1.945 0 CA-C-O 124.213 1.959 . . . . 0.0 114.131 -176.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.4 t -95.29 149.61 21.16 Favored 'General case' 0 CA--C 1.565 1.543 0 CA-C-O 124.066 1.889 . . . . 0.0 111.122 173.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.7 p -93.33 113.01 25.09 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 114.405 -1.27 . . . . 0.0 108.307 174.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.4 -8.32 59.02 Favored 'General case' 0 CA--C 1.563 1.462 0 N-CA-C 117.426 2.38 . . . . 0.0 117.426 -175.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . 0.334 0.2 OUTLIER -94.65 176.12 6.4 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 117.383 2.364 . . . . 0.0 117.383 -174.513 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.4 m 79.04 -147.08 0.02 OUTLIER 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 100.793 -3.78 . . . . 0.0 100.793 -167.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.596 2.8 mm? -177.98 -77.0 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.025 0 O-C-N 116.991 -3.568 . . . . 0.0 110.583 162.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -77.87 -20.31 53.25 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.91 -1.119 . . . . 0.0 112.607 171.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -90.0 -152.42 26.87 Favored Glycine 0 CA--C 1.55 2.242 0 CA-C-O 123.338 1.521 . . . . 0.0 112.507 172.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.0 t -84.62 139.41 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 CA-C-O 123.026 1.394 . . . . 0.0 114.038 -165.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -105.65 156.16 18.54 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -174.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -90.91 -68.07 0.81 Allowed 'General case' 0 N--CA 1.503 2.215 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 -175.042 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -116.91 96.03 5.28 Favored 'General case' 0 CA--C 1.567 1.616 0 N-CA-C 101.747 -3.427 . . . . 0.0 101.747 170.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 66.9 m -39.03 149.86 0.23 Allowed Pre-proline 0 CA--C 1.578 2.03 0 N-CA-C 120.547 3.536 . . . . 0.0 120.547 -173.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -65.63 170.9 10.41 Favored 'Trans proline' 0 CA--C 1.568 2.197 0 C-N-CA 122.223 1.949 . . . . 0.0 114.552 174.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 95.3 m -88.76 178.37 6.48 Favored 'General case' 0 CA--C 1.571 1.758 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 -174.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -61.55 174.53 0.75 Allowed 'General case' 0 CA--C 1.579 2.092 0 N-CA-C 117.494 2.405 . . . . 0.0 117.494 -174.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 24.6 tpt180 -61.02 111.63 1.76 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.124 -1.61 . . . . 0.0 113.136 -175.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 96.79 -19.74 53.49 Favored Glycine 0 N--CA 1.499 2.88 0 N-CA-C 116.892 1.517 . . . . 0.0 116.892 -172.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.94 120.35 38.17 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 124.804 1.242 . . . . 0.0 108.603 176.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.81 164.31 12.62 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 115.532 1.679 . . . . 0.0 115.532 -172.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 14.4 t -91.8 104.41 16.86 Favored 'General case' 0 CA--C 1.566 1.559 0 CA-C-N 113.306 -1.77 . . . . 0.0 107.32 171.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 . . . . . 0 N--CA 1.494 1.746 0 CA-C-N 121.525 1.966 . . . . 0.0 107.533 -177.792 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 . . . . . 0 CA--C 1.574 1.876 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -126.92 171.7 18.53 Favored Glycine 0 N--CA 1.494 2.507 0 O-C-N 120.915 -1.116 . . . . 0.0 114.397 175.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.6 mm -96.96 139.99 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.246 0 O-C-N 119.883 -1.951 . . . . 0.0 112.118 -168.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 3.8 m -74.3 131.92 41.61 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.249 -1.532 . . . . 0.0 114.39 173.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 64.7 m-70 -140.59 158.62 43.72 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 122.531 1.158 . . . . 0.0 110.98 177.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -95.94 130.21 42.98 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 120.964 -1.085 . . . . 0.0 111.623 -176.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.6 p . . . . . 0 N--CA 1.497 1.886 0 N-CA-C 114.719 1.377 . . . . 0.0 114.719 -173.407 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 . . . . . 0 N--CA 1.508 2.434 0 CA-C-O 121.416 0.627 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.73 139.9 51.99 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 123.363 1.554 . . . . 0.0 114.61 -176.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.5 156.88 30.71 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 122.241 1.02 . . . . 0.0 113.138 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -80.9 119.7 23.78 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 122.716 1.246 . . . . 0.0 109.02 -175.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 129.64 -20.61 5.16 Favored Glycine 0 CA--C 1.558 2.769 0 CA-C-N 114.222 -1.354 . . . . 0.0 114.692 -171.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.284 6.0 tp10 -99.62 158.85 15.47 Favored 'General case' 0 CA--C 1.572 1.802 0 CA-C-N 119.436 1.618 . . . . 0.0 112.036 -178.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.8 tp -75.37 135.44 40.81 Favored 'General case' 0 CA--C 1.578 2.028 0 O-C-N 120.963 -1.085 . . . . 0.0 113.714 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.9 p -133.85 159.74 39.75 Favored 'General case' 0 CA--C 1.564 1.514 0 C-N-CA 124.871 1.268 . . . . 0.0 112.361 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.7 mt -92.48 -77.14 0.44 Allowed 'General case' 0 CA--C 1.566 1.59 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 173.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.3 p30 -91.24 167.38 12.36 Favored 'General case' 0 CA--C 1.58 2.117 0 N-CA-C 115.43 1.641 . . . . 0.0 115.43 174.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.2 m -70.51 -20.79 62.81 Favored 'General case' 0 N--CA 1.509 2.52 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 174.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.96 4.45 5.37 Favored 'General case' 0 CA--C 1.579 2.088 0 N-CA-C 116.909 2.188 . . . . 0.0 116.909 174.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -94.83 -31.48 13.7 Favored 'General case' 0 CA--C 1.565 1.522 0 C-N-CA 125.082 1.353 . . . . 0.0 114.371 174.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 11.2 m -78.17 157.59 29.34 Favored 'General case' 0 CA--C 1.574 1.881 0 CA-C-N 121.703 2.047 . . . . 0.0 114.18 177.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -61.97 -57.07 13.1 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.753 -1.217 . . . . 0.0 109.506 172.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.7 m -83.82 110.6 18.48 Favored 'General case' 0 CA--C 1.567 1.597 0 N-CA-C 102.737 -3.06 . . . . 0.0 102.737 169.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -66.27 82.47 0.09 Allowed 'General case' 0 N--CA 1.502 2.141 0 CA-C-O 124.187 1.946 . . . . 0.0 114.153 -172.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.6 t -154.03 82.75 1.14 Allowed 'General case' 0 CA--C 1.567 1.611 0 CA-C-N 112.843 -1.98 . . . . 0.0 112.956 -173.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.9 t -85.6 111.86 20.44 Favored 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 104.231 -2.507 . . . . 0.0 104.231 171.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.15 123.06 43.16 Favored 'General case' 0 CA--C 1.561 1.388 0 CA-C-O 122.443 1.116 . . . . 0.0 112.841 -171.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -79.82 129.5 34.53 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.111 0.964 . . . . 0.0 112.404 -173.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -76.41 43.57 0.31 Allowed 'General case' 0 CA--C 1.583 2.218 0 N-CA-C 116.414 2.005 . . . . 0.0 116.414 174.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 43.7 p 61.03 88.28 0.09 Allowed 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 125.769 1.628 . . . . 0.0 114.306 174.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 23.6 mm 75.11 -57.19 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.613 0 C-N-CA 125.138 1.375 . . . . 0.0 113.264 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -42.67 -44.98 4.52 Favored 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 118.361 2.726 . . . . 0.0 118.361 -177.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.338 28.6 p 96.47 -4.91 0.07 Allowed 'General case' 0 N--CA 1.507 2.408 0 N-CA-C 118.81 2.893 . . . . 0.0 118.81 173.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 mp -74.61 95.35 2.8 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 121.926 2.148 . . . . 0.0 106.609 172.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.8 m -97.64 134.07 41.33 Favored 'General case' 0 CA--C 1.559 1.317 0 CA-C-N 114.661 -1.154 . . . . 0.0 113.67 -170.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 68.3 ttp85 -114.24 144.57 43.0 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.224 1.01 . . . . 0.0 111.687 -176.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 75.1 m -69.4 132.5 46.46 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 119.92 -1.737 . . . . 0.0 111.096 173.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.27 178.92 7.08 Favored 'General case' 0 CA--C 1.568 1.643 0 N-CA-C 115.151 1.537 . . . . 0.0 115.151 -173.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.82 160.29 18.81 Favored 'General case' 0 CA--C 1.573 1.842 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 178.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.59 156.63 25.08 Favored 'General case' 0 CA--C 1.582 2.173 0 CA-C-O 121.923 0.868 . . . . 0.0 112.533 175.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.01 166.21 21.79 Favored 'General case' 0 CA--C 1.572 1.819 0 N-CA-C 116.588 2.07 . . . . 0.0 116.588 -175.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 13.4 mtp-105 -131.33 171.39 13.41 Favored 'General case' 0 CA--C 1.564 1.519 0 CA-C-N 113.961 -1.472 . . . . 0.0 111.555 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -45.98 129.79 9.71 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 116.682 2.105 . . . . 0.0 116.682 -174.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 73.04 10.1 5.31 Favored 'General case' 0 N--CA 1.505 2.298 0 N-CA-C 115.623 1.712 . . . . 0.0 115.623 -174.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.0 t -107.92 159.49 16.49 Favored 'General case' 0 CA--C 1.567 1.607 0 CA-C-O 122.969 1.366 . . . . 0.0 111.286 174.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -71.39 128.4 35.73 Favored 'General case' 0 CA--C 1.563 1.466 0 CA-C-O 123.164 1.459 . . . . 0.0 114.006 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -122.37 128.53 51.09 Favored 'General case' 0 CA--C 1.561 1.387 0 CA-C-N 113.304 -1.771 . . . . 0.0 108.974 173.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.3 t -86.7 97.49 10.61 Favored 'General case' 0 CA--C 1.558 1.253 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.555 173.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.52 76.63 5.02 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 123.616 1.674 . . . . 0.0 112.159 -176.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -144.67 153.74 42.06 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 117.419 2.378 . . . . 0.0 117.419 -171.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.1 p -149.25 135.96 19.54 Favored 'General case' 0 CA--C 1.558 1.267 0 CA-C-O 124.265 1.983 . . . . 0.0 106.3 169.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.287 1.9 pp -141.35 -80.11 0.25 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 112.982 -1.917 . . . . 0.0 105.917 -176.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -150.84 -1.42 0.37 Allowed 'General case' 0 CA--C 1.591 2.522 0 C-N-CA 126.409 1.883 . . . . 0.0 110.759 172.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 170.97 -83.71 0.08 OUTLIER Glycine 0 C--N 1.351 1.391 0 O-C-N 119.046 -2.284 . . . . 0.0 117.686 -173.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 2.4 t -78.39 137.05 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 CA-C-N 119.758 1.779 . . . . 0.0 113.035 -157.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -123.96 130.5 52.69 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.109 -1.405 . . . . 0.0 110.458 -173.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -62.54 -43.73 98.09 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -178.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.6 mptt -139.33 106.87 5.57 Favored 'General case' 0 CA--C 1.562 1.434 0 N-CA-C 103.519 -2.771 . . . . 0.0 103.519 173.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.0 m -49.65 147.78 5.82 Favored Pre-proline 0 CA--C 1.591 2.525 0 N-CA-C 117.058 2.244 . . . . 0.0 117.058 -174.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -60.75 172.35 2.92 Favored 'Trans proline' 0 CA--C 1.569 2.231 0 C-N-CA 122.877 2.385 . . . . 0.0 118.003 -173.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 35.3 m -73.0 161.69 30.39 Favored 'General case' 0 CA--C 1.573 1.833 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -174.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -62.53 156.73 22.2 Favored 'General case' 0 CA--C 1.577 2.007 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -61.73 109.45 1.22 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.745 -1.222 . . . . 0.0 113.495 -174.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.86 -24.82 18.35 Favored Glycine 0 N--CA 1.5 2.923 0 N-CA-C 116.502 1.361 . . . . 0.0 116.502 -172.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 tt -98.28 136.7 38.09 Favored 'General case' 0 CA--C 1.574 1.877 0 C-N-CA 124.897 1.279 . . . . 0.0 109.034 176.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.89 159.01 15.2 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 116.855 2.169 . . . . 0.0 116.855 -172.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 9.1 t -95.55 132.43 40.68 Favored 'General case' 0 CA--C 1.573 1.849 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.329 171.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.298 2.8 pp20? . . . . . 0 N--CA 1.506 2.339 0 CA-C-N 122.096 2.226 . . . . 0.0 112.169 177.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 122.097 0.951 . . . . 0.0 112.822 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.42 162.17 41.12 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 118.608 2.203 . . . . 0.0 118.608 175.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 19.6 mm -98.43 148.3 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.003 0 CA-C-O 122.587 1.184 . . . . 0.0 109.459 176.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.8 m -72.66 125.3 27.15 Favored 'General case' 0 CA--C 1.571 1.765 0 O-C-N 120.397 -1.439 . . . . 0.0 113.153 173.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 70.7 m-70 -140.51 152.29 45.46 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 120.245 -1.534 . . . . 0.0 111.573 176.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -96.94 122.57 40.06 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-O 122.102 0.953 . . . . 0.0 109.674 177.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 46.0 t . . . . . 0 N--CA 1.503 2.184 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -174.553 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 . . . . . 0 CA--C 1.582 2.204 0 N-CA-C 116.374 1.99 . . . . 0.0 116.374 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -149.68 146.05 27.04 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 123.34 1.543 . . . . 0.0 113.249 173.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -84.82 171.64 12.09 Favored 'General case' 0 CA--C 1.569 1.709 0 N-CA-C 114.071 1.138 . . . . 0.0 114.071 -178.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.21 127.51 31.62 Favored 'General case' 0 CA--C 1.575 1.906 0 O-C-N 121.14 -0.975 . . . . 0.0 111.466 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 117.41 -20.74 11.06 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 117.061 1.584 . . . . 0.0 117.061 -173.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -101.87 153.44 19.84 Favored 'General case' 0 CA--C 1.575 1.912 0 CA-C-N 119.064 1.432 . . . . 0.0 112.319 -179.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 tt -74.55 129.66 38.16 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.075 -1.016 . . . . 0.0 113.464 -174.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.6 p -127.02 151.24 48.86 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 124.272 1.029 . . . . 0.0 112.955 178.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.8 mp -87.79 -71.78 0.56 Allowed 'General case' 0 CA--C 1.57 1.719 0 O-C-N 120.946 -1.096 . . . . 0.0 108.46 173.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -95.25 173.48 7.53 Favored 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 120.531 1.514 . . . . 0.0 114.563 173.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.3 m -77.98 -19.1 55.11 Favored 'General case' 0 N--CA 1.505 2.282 0 N-CA-C 117.204 2.298 . . . . 0.0 117.204 176.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.91 10.69 2.64 Favored 'General case' 0 CA--C 1.58 2.131 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 172.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -94.41 -46.66 6.92 Favored 'General case' 0 CA--C 1.558 1.287 0 CA-C-O 117.67 -1.157 . . . . 0.0 113.071 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.9 m -65.87 149.24 50.51 Favored 'General case' 0 CA--C 1.576 1.959 0 CA-C-N 122.076 2.216 . . . . 0.0 113.685 178.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.0 mmmp? -59.37 -53.61 56.17 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 120.621 -1.3 . . . . 0.0 110.536 172.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 87.6 p -82.96 100.0 10.15 Favored 'General case' 0 CA--C 1.572 1.817 0 N-CA-C 102.179 -3.267 . . . . 0.0 102.179 167.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 51.6 m-80 -67.64 85.46 0.19 Allowed 'General case' 0 N--CA 1.501 2.12 0 CA-C-O 125.238 2.447 . . . . 0.0 114.611 -170.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 t -152.31 77.77 1.2 Allowed 'General case' 0 CA--C 1.562 1.424 0 CA-C-N 111.216 -2.72 . . . . 0.0 110.725 -173.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.3 t -82.1 111.16 17.98 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 172.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.52 130.28 46.57 Favored 'General case' 0 CA--C 1.556 1.193 0 CA-C-O 122.145 0.974 . . . . 0.0 111.338 -172.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -79.42 173.34 12.68 Favored 'General case' 0 CA--C 1.568 1.638 0 N-CA-C 114.894 1.442 . . . . 0.0 114.894 -173.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 44.6 p-10 -80.46 -63.98 1.29 Allowed 'General case' 0 CA--C 1.568 1.673 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 173.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.5 m -160.8 -83.76 0.04 OUTLIER 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 104.479 -2.415 . . . . 0.0 104.479 171.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 69.4 mt -123.53 -22.45 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.302 0 CA-C-N 120.116 1.325 . . . . 0.0 112.805 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.9 tp -76.89 -113.94 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 122.467 2.394 . . . . 0.0 111.642 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 95.3 p -161.05 101.67 1.26 Allowed 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 122.733 2.515 . . . . 0.0 115.571 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.8 tp -163.79 86.36 0.49 Allowed 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 103.821 -2.659 . . . . 0.0 103.821 172.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 11.8 m -105.77 129.56 53.94 Favored 'General case' 0 CA--C 1.566 1.576 0 CA-C-O 122.532 1.158 . . . . 0.0 112.712 -172.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 19.2 ttp180 -132.49 146.59 52.05 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.368 1.067 . . . . 0.0 110.655 -175.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 73.2 m -67.98 142.32 56.0 Favored 'General case' 0 CA--C 1.563 1.475 0 O-C-N 119.821 -1.799 . . . . 0.0 113.598 176.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.83 -173.81 3.81 Favored 'General case' 0 CA--C 1.569 1.693 0 CA-C-N 114.202 -1.363 . . . . 0.0 113.664 -174.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.9 mt -92.29 154.37 18.64 Favored 'General case' 0 CA--C 1.57 1.736 0 CA-C-O 122.47 1.128 . . . . 0.0 112.732 176.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.85 150.63 34.16 Favored 'General case' 0 CA--C 1.575 1.909 0 C-N-CA 123.648 0.779 . . . . 0.0 112.387 173.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.67 158.63 29.62 Favored 'General case' 0 CA--C 1.568 1.653 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 -173.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -115.23 168.59 9.82 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 113.464 -1.698 . . . . 0.0 111.414 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -53.55 130.16 35.02 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -174.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 72.05 27.91 2.6 Favored 'General case' 0 N--CA 1.506 2.338 0 C-N-CA 124.875 1.27 . . . . 0.0 114.101 -173.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.8 m -125.08 150.03 47.23 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.658 -1.277 . . . . 0.0 110.345 174.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -71.68 131.19 42.81 Favored 'General case' 0 CA--C 1.57 1.74 0 CA-C-O 122.941 1.353 . . . . 0.0 112.452 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.416 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 25.0 p -134.14 160.74 36.89 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-N 113.74 -1.573 . . . . 0.0 114.995 -174.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.1 m -79.38 101.94 8.41 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.892 0.854 . . . . 0.0 109.672 176.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -76.86 -47.56 20.93 Favored 'General case' 0 CA--C 1.571 1.783 0 N-CA-C 115.751 1.76 . . . . 0.0 115.751 -174.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -102.7 104.84 15.2 Favored 'General case' 0 CA--C 1.568 1.635 0 C-N-CA 124.599 1.16 . . . . 0.0 108.057 174.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.3 p -98.55 134.29 41.72 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 123.559 1.647 . . . . 0.0 113.799 -174.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -98.58 -170.83 2.01 Favored 'General case' 0 CA--C 1.578 2.031 0 CA-C-N 112.462 -2.153 . . . . 0.0 108.939 172.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -99.58 62.23 1.2 Allowed 'General case' 0 N--CA 1.501 2.119 0 CA-C-O 123.518 1.628 . . . . 0.0 108.38 174.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -169.49 -168.79 31.95 Favored Glycine 0 N--CA 1.475 1.275 0 CA-C-O 123.593 1.663 . . . . 0.0 114.149 -173.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.1 t -78.78 147.68 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 CA-C-O 123.215 1.483 . . . . 0.0 112.619 -163.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -117.09 138.34 51.69 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-N 114.313 -1.312 . . . . 0.0 113.396 -173.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -68.36 -33.16 73.77 Favored 'General case' 0 CA--C 1.589 2.479 0 O-C-N 121.256 -0.902 . . . . 0.0 112.697 172.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.56 109.65 3.72 Favored 'General case' 0 CA--C 1.566 1.59 0 N-CA-C 105.324 -2.102 . . . . 0.0 105.324 177.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 59.2 m -52.17 157.05 2.42 Favored Pre-proline 0 CA--C 1.591 2.551 0 N-CA-C 118.78 2.881 . . . . 0.0 118.78 -174.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -54.14 167.18 1.29 Allowed 'Trans proline' 0 CA--C 1.566 2.094 0 C-N-CA 123.374 2.716 . . . . 0.0 118.032 176.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.416 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 69.3 m -71.43 162.2 29.83 Favored 'General case' 0 CA--C 1.574 1.884 0 N-CA-C 115.028 1.492 . . . . 0.0 115.028 177.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -62.62 161.18 12.61 Favored 'General case' 0 CA--C 1.576 1.966 0 N-CA-C 115.624 1.712 . . . . 0.0 115.624 177.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 72.3 ttt180 -62.0 116.88 5.28 Favored 'General case' 0 CA--C 1.572 1.792 0 O-C-N 120.697 -1.252 . . . . 0.0 112.888 -175.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.29 -21.44 41.33 Favored Glycine 0 CA--C 1.559 2.842 0 N-CA-C 117.101 1.6 . . . . 0.0 117.101 -172.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 tp -99.78 141.27 32.8 Favored 'General case' 0 CA--C 1.572 1.814 0 C-N-CA 124.803 1.241 . . . . 0.0 111.545 -179.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -99.11 151.27 21.16 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.409 -1.432 . . . . 0.0 113.945 -174.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 13.1 t -95.41 99.12 11.08 Favored 'General case' 0 CA--C 1.57 1.715 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.49 172.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 . . . . . 0 N--CA 1.497 1.912 0 O-C-N 120.483 -1.386 . . . . 0.0 110.38 -179.766 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.0 m-30 . . . . . 0 N--CA 1.495 1.823 0 N-CA-C 116.216 1.932 . . . . 0.0 116.216 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -146.17 174.55 26.04 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 115.902 1.121 . . . . 0.0 115.902 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.8 mm -111.39 143.27 21.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 CA-C-O 122.17 0.986 . . . . 0.0 109.865 -177.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 69.4 m -71.04 120.61 16.85 Favored 'General case' 0 CA--C 1.569 1.701 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 174.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 71.8 m-70 -142.02 161.07 38.91 Favored 'General case' 0 CA--C 1.565 1.55 0 CA-C-O 123.349 1.547 . . . . 0.0 111.751 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -97.66 102.36 14.1 Favored 'General case' 0 CA--C 1.563 1.466 0 O-C-N 120.932 -1.105 . . . . 0.0 110.732 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 41.4 t . . . . . 0 N--CA 1.498 1.963 0 CA-C-O 122.354 1.074 . . . . 0.0 108.635 -175.1 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 . . . . . 0 N--CA 1.501 2.123 0 CA-C-O 122.409 1.099 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -125.83 149.85 48.31 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 123.402 1.572 . . . . 0.0 113.799 -177.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -79.5 165.05 23.42 Favored 'General case' 0 CA--C 1.573 1.832 0 O-C-N 120.944 -1.097 . . . . 0.0 112.358 174.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.21 132.64 44.37 Favored 'General case' 0 CA--C 1.574 1.868 0 O-C-N 120.611 -1.306 . . . . 0.0 111.348 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 116.28 13.89 8.0 Favored Glycine 0 CA--C 1.558 2.776 0 N-CA-C 115.705 1.042 . . . . 0.0 115.705 -172.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -129.49 152.3 49.17 Favored 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 119.187 1.493 . . . . 0.0 110.433 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 54.3 mt -72.28 125.94 28.58 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.095 -1.003 . . . . 0.0 113.304 -177.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.8 p -121.29 143.51 49.13 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 124.164 0.985 . . . . 0.0 112.271 -177.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.5 mt -78.77 -72.13 0.4 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.035 -1.04 . . . . 0.0 109.279 174.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 60.7 m-20 -99.03 -165.59 1.25 Allowed 'General case' 0 CA--C 1.578 2.046 0 CA-C-N 119.229 0.922 . . . . 0.0 112.551 172.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.1 t -82.8 -24.68 33.29 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 119.784 -1.822 . . . . 0.0 114.964 172.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.24 62.66 6.06 Favored 'General case' 0 CA--C 1.574 1.867 0 CA-C-O 125.057 2.36 . . . . 0.0 111.672 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -137.68 -59.49 0.67 Allowed 'General case' 0 CA--C 1.566 1.558 0 CA-C-N 111.531 -2.577 . . . . 0.0 109.929 -174.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 71.9 m -83.29 155.03 23.82 Favored 'General case' 0 CA--C 1.57 1.734 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 175.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.6 mtpt -60.75 -53.51 56.51 Favored 'General case' 0 N--CA 1.502 2.147 0 C-N-CA 124.089 0.956 . . . . 0.0 109.877 171.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 92.2 p -81.88 101.84 10.48 Favored 'General case' 0 CA--C 1.569 1.689 0 N-CA-C 105.353 -2.091 . . . . 0.0 105.353 170.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -72.7 76.72 1.11 Allowed 'General case' 0 N--CA 1.501 2.121 0 CA-C-O 124.973 2.32 . . . . 0.0 113.418 -173.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 t -139.94 70.54 1.36 Allowed 'General case' 0 CA--C 1.562 1.427 0 CA-C-N 111.99 -2.368 . . . . 0.0 108.28 -178.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.2 t -78.0 108.75 11.5 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 173.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.18 120.16 39.46 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-O 122.861 1.315 . . . . 0.0 112.856 -171.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -82.18 153.6 25.89 Favored 'General case' 0 CA--C 1.563 1.48 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -174.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -76.8 8.2 3.94 Favored 'General case' 0 CA--C 1.586 2.352 0 N-CA-C 116.402 2.001 . . . . 0.0 116.402 172.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.277 44.3 p 75.81 97.07 0.07 Allowed 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 127.063 2.145 . . . . 0.0 111.681 -178.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.28 4.2 mp 75.27 -46.94 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 C-N-CA 125.565 1.546 . . . . 0.0 114.305 174.41 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.0 mp -77.83 -126.85 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.158 0 CA-C-N 121.565 1.984 . . . . 0.0 112.249 -174.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.1 p -156.84 94.6 1.45 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 122.924 2.602 . . . . 0.0 116.119 178.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 tt -161.28 92.75 0.92 Allowed 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 103.724 -2.695 . . . . 0.0 103.724 173.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.5 m -110.32 116.11 30.88 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.312 -0.868 . . . . 0.0 112.222 -173.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -124.12 137.55 54.54 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 124.242 1.017 . . . . 0.0 109.782 -178.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 98.5 m -68.58 142.39 55.19 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 119.989 -1.694 . . . . 0.0 113.46 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -135.35 -176.75 4.37 Favored 'General case' 0 CA--C 1.565 1.555 0 CA-C-N 113.558 -1.656 . . . . 0.0 113.183 -173.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.6 pp -82.29 161.9 22.47 Favored 'General case' 0 CA--C 1.572 1.799 0 CA-C-O 122.429 1.109 . . . . 0.0 112.807 174.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -77.97 152.99 32.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.213 -0.929 . . . . 0.0 112.713 175.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.62 159.0 30.65 Favored 'General case' 0 CA--C 1.569 1.697 0 CA-C-O 123.972 1.844 . . . . 0.0 115.278 -174.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 56.8 mtt85 -126.53 168.13 14.69 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-N 113.475 -1.693 . . . . 0.0 110.939 -177.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -44.51 135.21 4.87 Favored 'General case' 0 CA--C 1.574 1.884 0 N-CA-C 116.953 2.205 . . . . 0.0 116.953 -173.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.39 6.6 p30 67.88 14.04 9.32 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 116.957 2.206 . . . . 0.0 116.957 -173.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.5 t -117.41 146.29 43.54 Favored 'General case' 0 CA--C 1.565 1.546 0 CA-C-O 122.867 1.318 . . . . 0.0 110.56 173.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -60.11 139.68 57.35 Favored 'General case' 0 CA--C 1.571 1.753 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 28.5 p -141.88 150.74 41.93 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 113.289 -1.778 . . . . 0.0 114.692 -174.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.8 t -79.83 109.67 14.47 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 173.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.03 -43.46 64.95 Favored 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -105.23 144.71 31.64 Favored 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 170.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 22.3 p -126.79 139.03 53.41 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.196 -1.565 . . . . 0.0 112.295 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -98.39 -169.24 1.77 Allowed 'General case' 0 CA--C 1.576 1.965 0 CA-C-N 113.098 -1.864 . . . . 0.0 109.513 173.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -103.22 62.53 0.79 Allowed 'General case' 0 N--CA 1.499 2.016 0 CA-C-O 123.258 1.504 . . . . 0.0 108.017 174.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -162.61 177.4 38.74 Favored Glycine 0 N--CA 1.475 1.272 0 CA-C-N 113.554 -1.657 . . . . 0.0 112.012 -174.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.4 t -78.34 141.06 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 CA-C-O 123.396 1.569 . . . . 0.0 111.764 -167.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -107.54 136.53 47.16 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 114.165 -1.38 . . . . 0.0 112.964 -172.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -68.41 -19.94 64.63 Favored 'General case' 0 CA--C 1.592 2.572 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 172.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.67 111.97 1.21 Allowed 'General case' 0 CA--C 1.575 1.925 0 C-N-CA 128.038 2.535 . . . . 0.0 104.837 -175.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 40.2 m -58.64 155.49 29.34 Favored Pre-proline 0 CA--C 1.588 2.442 0 O-C-N 118.946 -2.346 . . . . 0.0 116.75 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -64.2 168.59 12.24 Favored 'Trans proline' 0 CA--C 1.573 2.434 0 C-N-CA 122.691 2.26 . . . . 0.0 115.678 175.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 60.9 m -73.94 150.26 40.91 Favored 'General case' 0 CA--C 1.575 1.94 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -177.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.71 -175.96 1.84 Allowed 'General case' 0 CA--C 1.583 2.23 0 N-CA-C 116.97 2.211 . . . . 0.0 116.97 -174.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.46 114.38 1.99 Allowed 'General case' 0 CA--C 1.572 1.826 0 O-C-N 120.474 -1.391 . . . . 0.0 114.306 -179.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 80.83 15.61 77.17 Favored Glycine 0 N--CA 1.493 2.489 0 N-CA-C 119.43 2.532 . . . . 0.0 119.43 -174.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 tt -132.75 132.46 42.31 Favored 'General case' 0 CA--C 1.568 1.641 0 CA-C-N 119.024 1.412 . . . . 0.0 108.267 -174.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.07 158.06 15.77 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -173.367 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 16.0 t -94.54 111.56 23.32 Favored 'General case' 0 CA--C 1.568 1.671 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.907 172.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 . . . . . 0 CA--C 1.567 1.619 0 O-C-N 120.452 -1.405 . . . . 0.0 110.818 -175.41 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 . . . . . 0 CA--C 1.574 1.902 0 CA-C-O 122.628 1.204 . . . . 0.0 112.82 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -102.41 169.58 19.65 Favored Glycine 0 N--CA 1.489 2.213 0 O-C-N 120.705 -1.247 . . . . 0.0 115.373 174.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 35.5 mm -110.54 135.46 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 173.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 23.1 m -63.2 131.1 47.3 Favored 'General case' 0 CA--C 1.57 1.748 0 O-C-N 120.528 -1.357 . . . . 0.0 114.352 173.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 -144.6 148.27 34.15 Favored 'General case' 0 CA--C 1.563 1.48 0 O-C-N 120.731 -1.23 . . . . 0.0 109.718 173.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -96.87 130.18 44.2 Favored 'General case' 0 CA--C 1.565 1.55 0 O-C-N 120.692 -1.255 . . . . 0.0 109.835 176.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 61.8 t . . . . . 0 N--CA 1.501 2.084 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.098 -174.212 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 . . . . . 0 N--CA 1.498 1.957 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -138.08 155.07 49.14 Favored 'General case' 0 CA--C 1.574 1.873 0 CA-C-O 122.401 1.096 . . . . 0.0 110.074 172.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -78.11 164.09 25.3 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 119.376 -2.077 . . . . 0.0 114.732 -173.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -73.91 150.18 41.01 Favored 'General case' 0 CA--C 1.573 1.854 0 CA-C-O 122.239 1.019 . . . . 0.0 110.606 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.59 24.76 34.96 Favored Glycine 0 CA--C 1.562 3.027 0 O-C-N 121.484 -0.76 . . . . 0.0 114.819 -170.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -132.95 143.57 49.55 Favored 'General case' 0 CA--C 1.569 1.699 0 C-N-CA 125.632 1.573 . . . . 0.0 108.763 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 34.9 mt -70.92 134.19 47.04 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -174.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.7 p -140.48 152.68 45.81 Favored 'General case' 0 CA--C 1.561 1.373 0 C-N-CA 124.002 0.921 . . . . 0.0 113.124 -174.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -85.4 -77.88 0.28 Allowed 'General case' 0 CA--C 1.567 1.616 0 CA-C-O 117.743 -1.122 . . . . 0.0 108.222 172.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -96.35 170.75 9.02 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 121.149 1.795 . . . . 0.0 114.114 174.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.8 m -69.4 -10.69 59.07 Favored 'General case' 0 N--CA 1.508 2.451 0 N-CA-C 117.077 2.251 . . . . 0.0 117.077 174.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.41 52.82 2.56 Favored 'General case' 0 CA--C 1.571 1.764 0 CA-C-O 123.554 1.645 . . . . 0.0 114.939 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -141.32 -49.59 0.41 Allowed 'General case' 0 CA--C 1.574 1.878 0 CA-C-N 113.968 -1.469 . . . . 0.0 113.98 -177.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 67.4 m -84.19 160.92 20.73 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 116.15 1.907 . . . . 0.0 116.15 -174.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -60.53 -54.24 47.79 Favored 'General case' 0 N--CA 1.504 2.232 0 C-N-CA 124.754 1.222 . . . . 0.0 109.112 171.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.8 t -82.64 92.25 7.12 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 102.07 -3.307 . . . . 0.0 102.07 167.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -72.75 69.19 0.9 Allowed 'General case' 0 N--CA 1.497 1.922 0 CA-C-O 124.64 2.162 . . . . 0.0 116.435 -170.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 43.9 t -145.44 96.39 2.82 Favored 'General case' 0 CA--C 1.557 1.225 0 CA-C-N 112.643 -2.071 . . . . 0.0 110.155 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 15.6 t -78.08 115.08 17.55 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 103.802 -2.666 . . . . 0.0 103.802 171.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -98.84 123.7 43.26 Favored 'General case' 0 CA--C 1.566 1.56 0 CA-C-O 123.156 1.455 . . . . 0.0 114.538 -170.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -87.23 116.77 25.54 Favored 'General case' 0 CA--C 1.562 1.418 0 CA-C-N 114.026 -1.443 . . . . 0.0 113.603 -174.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -83.42 56.35 3.54 Favored 'General case' 0 CA--C 1.581 2.143 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 174.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 17.7 p 77.18 109.73 0.07 Allowed 'General case' 0 N--CA 1.505 2.308 0 N-CA-C 119.454 3.131 . . . . 0.0 119.454 171.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.302 4.7 mp 53.52 -87.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 C-N-CA 126.79 2.036 . . . . 0.0 115.766 172.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.7 tp -103.37 88.1 3.03 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 175.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 54.4 p -136.2 150.5 49.04 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 116.303 1.964 . . . . 0.0 116.303 -172.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 46.2 tp -80.37 117.09 20.81 Favored 'General case' 0 CA--C 1.569 1.709 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 173.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.9 m -92.6 137.2 32.57 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 122.964 1.364 . . . . 0.0 114.515 -171.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.8 ttt180 -134.53 137.35 43.76 Favored 'General case' 0 N--CA 1.495 1.8 0 C-N-CA 124.055 0.942 . . . . 0.0 110.181 -174.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 67.1 m -65.98 148.23 52.12 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 119.606 -1.934 . . . . 0.0 114.946 -177.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.67 -179.47 5.94 Favored 'General case' 0 CA--C 1.57 1.74 0 CA-C-N 113.488 -1.687 . . . . 0.0 112.83 -174.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.2 mt -81.65 138.91 35.24 Favored 'General case' 0 CA--C 1.566 1.579 0 O-C-N 121.069 -1.02 . . . . 0.0 112.932 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.9 pttt -70.67 134.5 47.58 Favored 'General case' 0 CA--C 1.573 1.852 0 O-C-N 121.606 -0.684 . . . . 0.0 110.3 173.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.41 154.73 38.66 Favored 'General case' 0 CA--C 1.561 1.389 0 N-CA-C 118.37 2.73 . . . . 0.0 118.37 -171.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -113.09 171.73 7.37 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 112.569 -2.105 . . . . 0.0 112.722 -177.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -58.94 125.01 21.79 Favored 'General case' 0 CA--C 1.568 1.669 0 CA-C-N 114.838 -1.073 . . . . 0.0 113.009 -174.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 85.51 18.22 0.12 Allowed 'General case' 0 CA--C 1.586 2.338 0 C-N-CA 125.956 1.702 . . . . 0.0 114.177 -173.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.3 t -119.77 151.79 38.24 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 119.953 -1.717 . . . . 0.0 112.312 175.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -74.51 120.71 20.44 Favored 'General case' 0 CA--C 1.575 1.918 0 CA-C-O 123.755 1.74 . . . . 0.0 112.534 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 87' ' ' CYS . 19.3 p -122.86 152.53 40.66 Favored 'General case' 0 CA--C 1.562 1.426 0 C-N-CA 127.146 2.178 . . . . 0.0 112.482 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 65.9 m -75.57 123.4 25.43 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.403 -1.436 . . . . 0.0 107.804 173.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.82 -49.33 25.73 Favored 'General case' 0 CA--C 1.565 1.525 0 N-CA-C 116.884 2.179 . . . . 0.0 116.884 -172.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -91.97 151.84 20.31 Favored 'General case' 0 CA--C 1.566 1.591 0 CA-C-N 118.758 0.708 . . . . 0.0 109.867 173.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.6 p -121.0 146.58 46.54 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 124.411 2.053 . . . . 0.0 110.588 174.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -98.47 -126.29 0.16 Allowed 'General case' 0 CA--C 1.569 1.711 0 CA-C-N 112.469 -2.15 . . . . 0.0 105.884 174.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -149.17 70.83 1.1 Allowed 'General case' 0 CA--C 1.564 1.511 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 169.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 175.47 -135.78 3.14 Favored Glycine 0 N--CA 1.483 1.819 0 CA-C-N 115.644 -0.707 . . . . 0.0 113.999 -176.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.4 t -79.76 144.22 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.175 0 CA-C-O 122.25 1.024 . . . . 0.0 112.196 -172.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -123.6 135.84 54.18 Favored 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 123.515 0.726 . . . . 0.0 112.56 -173.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -60.42 -51.08 71.02 Favored 'General case' 0 N--CA 1.503 2.218 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 177.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -135.41 122.02 20.79 Favored 'General case' 0 CA--C 1.559 1.311 0 N-CA-C 103.892 -2.633 . . . . 0.0 103.892 174.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 97.2 m -43.91 130.66 4.2 Favored Pre-proline 0 CA--C 1.592 2.588 0 N-CA-C 117.852 2.538 . . . . 0.0 117.852 -174.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -77.65 60.75 7.28 Favored 'Trans proline' 0 CA--C 1.576 2.614 0 C-N-CA 123.179 2.586 . . . . 0.0 118.637 -173.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 37.8 m 61.7 163.92 0.08 Allowed 'General case' 0 CA--C 1.582 2.198 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.42 174.07 11.83 Favored 'General case' 0 CA--C 1.575 1.94 0 N-CA-C 115.19 1.552 . . . . 0.0 115.19 178.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.99 108.65 1.26 Allowed 'General case' 0 CA--C 1.574 1.868 0 O-C-N 120.476 -1.39 . . . . 0.0 112.469 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 93.18 27.7 13.07 Favored Glycine 0 N--CA 1.497 2.709 0 N-CA-C 118.036 1.974 . . . . 0.0 118.036 -173.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 12.3 tp -140.9 138.42 33.87 Favored 'General case' 0 CA--C 1.567 1.614 0 CA-C-N 118.794 1.297 . . . . 0.0 110.225 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -98.74 154.1 18.23 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.708 -1.245 . . . . 0.0 112.828 -176.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.2 t -94.77 146.62 24.06 Favored 'General case' 0 CA--C 1.575 1.911 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.943 172.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 . . . . . 0 N--CA 1.5 2.045 0 O-C-N 120.381 -1.449 . . . . 0.0 110.378 178.45 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 . . . . . 0 CA--C 1.574 1.902 0 CA-C-O 122.27 1.033 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.22 162.33 23.85 Favored Glycine 0 N--CA 1.495 2.576 0 N-CA-C 119.116 2.406 . . . . 0.0 119.116 -174.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 23.2 mm -95.96 136.76 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 O-C-N 120.975 -1.309 . . . . 0.0 110.774 -171.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 53.2 m -67.85 124.22 22.72 Favored 'General case' 0 CA--C 1.569 1.691 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 174.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -144.12 159.79 42.04 Favored 'General case' 0 CA--C 1.565 1.525 0 CA-C-O 123.328 1.537 . . . . 0.0 111.642 174.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -99.44 132.64 44.63 Favored 'General case' 0 CA--C 1.564 1.512 0 O-C-N 120.855 -1.153 . . . . 0.0 110.7 175.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 59.9 t . . . . . 0 CA--C 1.588 2.43 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -179.372 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.58 2.128 0 N-CA-C 118.017 2.599 . . . . 0.0 118.017 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 mt -131.54 146.48 52.24 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 123.568 1.651 . . . . 0.0 113.838 175.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -80.51 162.6 24.27 Favored 'General case' 0 CA--C 1.567 1.616 0 CA-C-N 114.193 -1.367 . . . . 0.0 113.47 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -76.72 131.78 38.95 Favored 'General case' 0 CA--C 1.578 2.041 0 N-CA-C 107.788 -1.189 . . . . 0.0 107.788 173.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 101.66 26.7 7.48 Favored Glycine 0 CA--C 1.561 2.948 0 CA-C-N 115.766 -0.652 . . . . 0.0 114.469 -171.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -129.24 139.46 51.83 Favored 'General case' 0 CA--C 1.566 1.574 0 C-N-CA 125.121 1.368 . . . . 0.0 109.243 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.0 mp -68.08 124.96 24.86 Favored 'General case' 0 CA--C 1.574 1.868 0 O-C-N 121.152 -0.967 . . . . 0.0 112.191 -178.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 6.8 p -131.39 152.1 50.94 Favored 'General case' 0 CA--C 1.561 1.399 0 C-N-CA 124.229 1.011 . . . . 0.0 113.072 -174.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 97.7 mt -84.09 -74.97 0.36 Allowed 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 118.092 -0.956 . . . . 0.0 108.917 174.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -98.57 172.93 7.18 Favored 'General case' 0 N--CA 1.501 2.09 0 CA-C-N 120.998 1.726 . . . . 0.0 113.331 173.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.9 m -71.92 -9.67 58.68 Favored 'General case' 0 N--CA 1.508 2.463 0 N-CA-C 116.639 2.089 . . . . 0.0 116.639 173.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.72 4.2 12.18 Favored 'General case' 0 CA--C 1.572 1.816 0 N-CA-C 118.27 2.693 . . . . 0.0 118.27 176.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -97.77 -35.59 10.49 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 115.346 1.609 . . . . 0.0 115.346 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 71.4 m -81.05 155.77 26.17 Favored 'General case' 0 CA--C 1.564 1.498 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 177.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -62.96 -50.9 68.98 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.385 -0.822 . . . . 0.0 110.089 172.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.0 p -82.46 97.39 8.38 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 102.851 -3.018 . . . . 0.0 102.851 167.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -70.85 80.55 0.63 Allowed 'General case' 0 N--CA 1.498 1.94 0 CA-C-O 124.6 2.143 . . . . 0.0 115.354 -171.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 41.0 t -158.28 93.12 1.2 Allowed 'General case' 0 CA--C 1.557 1.218 0 CA-C-N 112.248 -2.251 . . . . 0.0 110.699 -176.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.8 t -80.22 113.98 18.79 Favored 'General case' 0 CA--C 1.56 1.348 0 N-CA-C 104.933 -2.247 . . . . 0.0 104.933 171.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 46.7 tp60 -91.99 115.79 28.37 Favored 'General case' 0 CA--C 1.558 1.287 0 CA-C-O 122.347 1.07 . . . . 0.0 113.884 -172.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 24.3 t-80 -81.1 117.28 21.54 Favored 'General case' 0 CA--C 1.562 1.432 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.734 176.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -72.15 56.83 0.34 Allowed 'General case' 0 CA--C 1.581 2.163 0 N-CA-C 116.923 2.194 . . . . 0.0 116.923 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 44.3 p 61.25 69.13 0.68 Allowed 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 126.037 1.735 . . . . 0.0 115.071 173.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.331 3.7 mp 71.1 -32.84 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.534 0 C-N-CA 125.191 1.396 . . . . 0.0 113.762 -179.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.1 tp -53.07 -20.95 4.06 Favored 'General case' 0 CA--C 1.586 2.364 0 N-CA-C 117.627 2.454 . . . . 0.0 117.627 174.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.288 26.3 p 77.93 1.44 2.83 Favored 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 121.692 3.96 . . . . 0.0 121.692 172.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.5 tp -73.64 96.25 2.45 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 121.711 2.05 . . . . 0.0 106.76 172.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.9 m -97.68 107.37 19.85 Favored 'General case' 0 CA--C 1.56 1.344 0 CA-C-O 123.139 1.447 . . . . 0.0 111.648 -171.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -131.22 132.83 44.93 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-N 114.546 -1.206 . . . . 0.0 108.98 -174.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 99.5 m -62.42 150.56 39.53 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 122.402 2.365 . . . . 0.0 116.504 -174.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -132.61 173.41 11.36 Favored 'General case' 0 CA--C 1.568 1.658 0 CA-C-N 114.162 -1.381 . . . . 0.0 113.842 -174.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 26.6 tp -85.47 146.19 27.07 Favored 'General case' 0 CA--C 1.569 1.677 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -174.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -69.95 143.32 52.7 Favored 'General case' 0 CA--C 1.577 2.001 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 175.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.93 169.61 17.96 Favored 'General case' 0 CA--C 1.579 2.077 0 N-CA-C 118.272 2.694 . . . . 0.0 118.272 -173.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 46.3 mtp180 -112.66 173.87 6.17 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 113.19 -1.823 . . . . 0.0 112.57 -178.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -64.2 136.76 57.51 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 122.083 0.944 . . . . 0.0 113.134 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 70.98 23.31 4.29 Favored 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 124.93 1.292 . . . . 0.0 114.118 -173.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.9 t -121.87 148.54 44.59 Favored 'General case' 0 CA--C 1.558 1.266 0 CA-C-O 122.596 1.189 . . . . 0.0 110.263 174.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -67.53 133.49 49.56 Favored 'General case' 0 CA--C 1.576 1.953 0 CA-C-O 123.749 1.738 . . . . 0.0 112.137 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 87' ' ' CYS . 22.3 p -137.41 156.43 48.2 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 112.855 -1.975 . . . . 0.0 112.552 -174.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 92.9 p -81.64 117.57 22.1 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 172.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.36 -55.31 7.3 Favored 'General case' 0 CA--C 1.583 2.244 0 CA-C-O 122.813 1.292 . . . . 0.0 108.181 172.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -155.24 127.64 7.82 Favored 'General case' 0 CA--C 1.573 1.838 0 N-CA-C 101.795 -3.409 . . . . 0.0 101.795 169.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.4 m -88.39 -70.43 0.64 Allowed 'General case' 0 CA--C 1.568 1.651 0 O-C-N 119.434 -2.042 . . . . 0.0 106.125 171.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -152.59 -72.67 0.14 Allowed 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 124.694 1.198 . . . . 0.0 109.816 173.284 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -162.43 -43.45 0.04 OUTLIER 'General case' 0 CA--C 1.579 2.084 0 C-N-CA 125.128 1.371 . . . . 0.0 113.851 -173.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -96.95 -120.44 3.94 Favored Glycine 0 N--CA 1.485 1.942 0 N-CA-C 116.94 1.536 . . . . 0.0 116.94 -172.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.1 t -82.16 141.04 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 CA-C-O 122.415 1.102 . . . . 0.0 111.11 -175.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 17.0 m-30 -122.65 148.84 44.79 Favored 'General case' 0 CA--C 1.559 1.317 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 -171.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -77.97 -9.05 58.91 Favored 'General case' 0 CA--C 1.585 2.311 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 173.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.61 140.04 9.45 Favored 'General case' 0 CA--C 1.571 1.752 0 C-N-CA 126.68 1.992 . . . . 0.0 106.686 -174.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 96.3 m -82.64 156.26 68.13 Favored Pre-proline 0 CA--C 1.581 2.135 0 N-CA-C 116.706 2.113 . . . . 0.0 116.706 177.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.51 171.52 16.96 Favored 'Trans proline' 0 CA--C 1.571 2.361 0 C-N-CA 122.704 2.269 . . . . 0.0 112.989 173.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 5.3 m -85.85 170.07 12.74 Favored 'General case' 0 CA--C 1.568 1.666 0 CA-C-O 123.751 1.739 . . . . 0.0 115.042 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -59.73 154.68 17.53 Favored 'General case' 0 CA--C 1.572 1.824 0 N-CA-C 115.805 1.78 . . . . 0.0 115.805 178.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -65.62 113.37 4.18 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 122.62 1.2 . . . . 0.0 112.427 -174.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 115.43 -27.08 8.66 Favored Glycine 0 N--CA 1.497 2.756 0 CA-C-N 114.099 -1.41 . . . . 0.0 116.355 -172.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 11.7 tp -97.42 138.81 34.29 Favored 'General case' 0 CA--C 1.569 1.688 0 CA-C-N 118.504 1.152 . . . . 0.0 110.936 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -97.19 148.82 22.69 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.424 -1.423 . . . . 0.0 113.443 -174.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 16.7 t -94.37 100.82 12.78 Favored 'General case' 0 CA--C 1.569 1.681 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.094 173.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 . . . . . 0 N--CA 1.497 1.917 0 CA-C-N 120.587 1.54 . . . . 0.0 111.66 -176.767 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 123.079 1.418 . . . . 0.0 110.159 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -166.18 154.73 25.5 Favored Glycine 0 N--CA 1.488 2.165 0 O-C-N 121.075 -1.016 . . . . 0.0 112.936 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.7 mm -94.19 138.43 20.59 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.161 0 CA-C-N 119.44 1.62 . . . . 0.0 109.188 -176.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 61.2 m -74.73 123.41 24.88 Favored 'General case' 0 CA--C 1.563 1.461 0 N-CA-C 116.177 1.917 . . . . 0.0 116.177 178.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -141.11 158.62 43.66 Favored 'General case' 0 CA--C 1.561 1.373 0 CA-C-O 123.488 1.614 . . . . 0.0 111.483 179.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -98.15 40.7 1.16 Allowed 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 174.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.0 t . . . . . 0 N--CA 1.502 2.14 0 C-N-CA 127.012 2.125 . . . . 0.0 113.811 174.897 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 55.7 m-80 . . . . . 0 CA--C 1.573 1.853 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mp -131.0 136.44 48.51 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.21 -1.557 . . . . 0.0 112.226 174.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -84.97 172.41 11.35 Favored 'General case' 0 CA--C 1.572 1.814 0 O-C-N 121.365 -0.835 . . . . 0.0 112.887 174.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -77.01 114.54 15.92 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 173.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 135.25 -8.97 4.41 Favored Glycine 0 CA--C 1.56 2.883 0 CA-C-N 114.298 -1.319 . . . . 0.0 115.627 -172.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -114.76 154.65 28.14 Favored 'General case' 0 CA--C 1.569 1.675 0 CA-C-N 120.084 1.942 . . . . 0.0 112.162 -177.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -81.83 147.95 29.1 Favored 'General case' 0 CA--C 1.574 1.866 0 CA-C-O 122.114 0.959 . . . . 0.0 113.303 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.6 p -137.55 -179.03 5.5 Favored 'General case' 0 CA--C 1.575 1.906 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -174.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.6 tp -99.29 -74.14 0.6 Allowed 'General case' 0 CA--C 1.58 2.121 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 171.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -94.87 -173.15 2.9 Favored 'General case' 0 N--CA 1.501 2.12 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 174.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.8 m -78.05 -31.93 50.59 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 119.79 -1.819 . . . . 0.0 114.703 172.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.83 65.43 4.99 Favored 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 124.706 2.193 . . . . 0.0 111.608 173.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -139.96 -50.17 0.48 Allowed 'General case' 0 CA--C 1.566 1.584 0 CA-C-N 111.89 -2.414 . . . . 0.0 111.258 -174.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 95.4 m -81.27 140.8 34.64 Favored 'General case' 0 CA--C 1.564 1.518 0 O-C-N 121.162 -0.961 . . . . 0.0 109.997 173.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -53.35 -30.3 38.69 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 118.694 2.85 . . . . 0.0 118.694 -173.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -79.78 -76.68 0.21 Allowed 'General case' 0 CA--C 1.574 1.879 0 CA-C-N 118.219 0.463 . . . . 0.0 110.516 173.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -173.07 -39.67 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.35 0 N-CA-C 116.565 2.061 . . . . 0.0 116.565 -176.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.3 t -97.71 110.52 23.07 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 119.711 3.226 . . . . 0.0 119.711 -169.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 22.5 t -95.41 118.87 32.93 Favored 'General case' 0 CA--C 1.562 1.409 0 N-CA-C 104.436 -2.431 . . . . 0.0 104.436 168.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.99 114.28 27.45 Favored 'General case' 0 CA--C 1.57 1.731 0 CA-C-O 123.185 1.469 . . . . 0.0 114.672 -172.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -82.52 155.54 24.49 Favored 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 126.432 1.893 . . . . 0.0 112.348 177.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.2 p30 -81.88 40.15 0.59 Allowed 'General case' 0 CA--C 1.587 2.396 0 O-C-N 120.434 -1.416 . . . . 0.0 114.21 172.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 48.7 p 63.54 90.02 0.08 Allowed 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 126.429 1.892 . . . . 0.0 113.68 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.301 3.2 mp 69.31 -38.04 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 174.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.3 mt -71.09 -87.41 0.02 OUTLIER 'General case' 0 CA--C 1.576 1.956 0 CA-C-N 122.405 2.366 . . . . 0.0 112.228 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 91.9 p -155.67 -131.25 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.022 0 CA-C-N 122.029 2.195 . . . . 0.0 114.005 174.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 20.7 tp 43.76 75.83 0.09 Allowed 'General case' 0 N--CA 1.502 2.125 0 C-N-CA 125.911 1.684 . . . . 0.0 115.113 -174.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.7 m -98.81 86.61 3.55 Favored 'General case' 0 CA--C 1.565 1.531 0 CA-C-O 122.205 1.002 . . . . 0.0 110.69 -174.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -120.36 127.66 52.52 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.653 1.181 . . . . 0.0 109.977 -174.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 74.8 m -66.6 140.42 57.94 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 116.281 1.956 . . . . 0.0 116.281 -174.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -142.34 173.17 11.77 Favored 'General case' 0 CA--C 1.565 1.554 0 CA-C-N 113.312 -1.767 . . . . 0.0 114.314 -173.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.6 pp -84.9 165.52 17.6 Favored 'General case' 0 CA--C 1.573 1.831 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 178.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -74.35 146.69 42.84 Favored 'General case' 0 CA--C 1.574 1.877 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.41 164.04 25.84 Favored 'General case' 0 CA--C 1.571 1.761 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -174.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 65.3 mtt180 -128.87 165.28 21.34 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 122.556 1.17 . . . . 0.0 112.338 -175.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -43.09 126.77 4.08 Favored 'General case' 0 CA--C 1.568 1.656 0 N-CA-C 117.3 2.333 . . . . 0.0 117.3 -172.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 72.39 17.97 4.66 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 115.248 1.573 . . . . 0.0 115.248 -174.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.7 t -117.75 150.32 39.3 Favored 'General case' 0 CA--C 1.565 1.533 0 CA-C-O 122.758 1.266 . . . . 0.0 110.619 174.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -65.33 122.0 16.12 Favored 'General case' 0 CA--C 1.573 1.85 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 -175.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.6 t -113.03 137.34 51.56 Favored 'General case' 0 CA--C 1.558 1.275 0 CA-C-N 113.489 -1.687 . . . . 0.0 111.232 174.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.1 t -99.68 115.68 30.03 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 172.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.19 -22.33 45.11 Favored 'General case' 0 CA--C 1.572 1.789 0 N-CA-C 115.997 1.851 . . . . 0.0 115.997 -178.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -129.33 154.64 46.68 Favored 'General case' 0 CA--C 1.578 2.027 0 N-CA-C 117.431 2.382 . . . . 0.0 117.431 -176.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.6 t 131.47 -152.51 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.523 2 N-CA-C 97.042 -5.17 . . . . 0.0 97.042 -171.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.653 3.6 mt 176.02 -69.36 0.01 OUTLIER 'General case' 0 N--CA 1.521 3.075 1 O-C-N 113.353 -5.842 . . . . 0.0 110.608 160.858 . . . . . . . . 3 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -78.8 -26.81 44.35 Favored 'General case' 0 CA--C 1.577 1.997 0 CA-C-N 112.433 -2.167 . . . . 0.0 108.883 168.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -81.97 159.76 40.05 Favored Glycine 0 CA--C 1.55 2.219 0 N-CA-C 107.619 -2.193 . . . . 0.0 107.619 170.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.6 t -70.87 135.67 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 CA-C-O 123.715 1.721 . . . . 0.0 112.028 -163.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 -66.7 124.23 22.3 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 113.014 -1.903 . . . . 0.0 114.779 -172.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -69.3 -40.63 77.57 Favored 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 114.787 1.402 . . . . 0.0 114.787 -174.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -149.95 103.84 3.24 Favored 'General case' 0 CA--C 1.569 1.684 0 N-CA-C 101.593 -3.484 . . . . 0.0 101.593 172.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 57.2 m -39.91 127.61 1.58 Allowed Pre-proline 0 CA--C 1.587 2.396 0 N-CA-C 116.913 2.19 . . . . 0.0 116.913 -173.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -47.83 166.33 0.12 Allowed 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 123.52 2.813 . . . . 0.0 119.266 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 58.4 m -68.01 146.09 53.86 Favored 'General case' 0 CA--C 1.569 1.686 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -178.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -178.72 1.42 Allowed 'General case' 0 CA--C 1.577 2.011 0 N-CA-C 115.268 1.581 . . . . 0.0 115.268 -176.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -60.84 112.45 2.05 Favored 'General case' 0 CA--C 1.571 1.76 0 O-C-N 120.349 -1.469 . . . . 0.0 113.096 -175.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.13 -20.65 35.17 Favored Glycine 0 N--CA 1.496 2.699 0 N-CA-C 118.629 2.212 . . . . 0.0 118.629 -173.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.1 mp -106.35 151.93 24.23 Favored 'General case' 0 CA--C 1.569 1.689 0 CA-C-N 118.841 1.32 . . . . 0.0 112.183 -178.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.96 158.26 17.87 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-O 122.368 1.08 . . . . 0.0 113.611 -176.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 6.1 t -90.71 120.04 31.43 Favored 'General case' 0 CA--C 1.57 1.745 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.526 173.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.582 2.193 0 CA-C-N 120.23 1.377 . . . . 0.0 111.775 -174.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.3 m-30 . . . . . 0 CA--C 1.57 1.716 0 CA-C-O 123.094 1.426 . . . . 0.0 110.541 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -139.39 -155.68 6.71 Favored Glycine 0 N--CA 1.48 1.575 0 O-C-N 120.909 -1.119 . . . . 0.0 114.555 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.9 mm -128.97 142.64 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 35.7 m -70.86 129.45 39.09 Favored 'General case' 0 CA--C 1.564 1.491 0 O-C-N 120.561 -1.337 . . . . 0.0 113.017 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 63.6 m-70 -140.46 155.81 46.57 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 123.203 1.478 . . . . 0.0 111.38 176.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -95.33 128.52 42.24 Favored 'General case' 0 CA--C 1.562 1.429 0 CA-C-O 122.367 1.079 . . . . 0.0 110.607 -176.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 9.9 m . . . . . 0 CA--C 1.579 2.072 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -174.792 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.375 0.0 OUTLIER . . . . . 0 CA--C 1.584 2.254 0 CA-C-O 122.628 1.204 . . . . 0.0 111.944 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.86 158.97 38.74 Favored 'General case' 0 CA--C 1.573 1.858 0 CA-C-O 122.989 1.376 . . . . 0.0 111.786 173.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -80.47 165.33 22.28 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.097 -1.627 . . . . 0.0 114.456 -174.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.89 123.69 26.1 Favored 'General case' 0 CA--C 1.574 1.887 0 O-C-N 121.44 -0.787 . . . . 0.0 111.036 -179.217 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 129.0 2.37 5.62 Favored Glycine 0 CA--C 1.557 2.677 0 N-CA-C 117.371 1.708 . . . . 0.0 117.371 -173.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -121.71 155.49 35.1 Favored 'General case' 0 CA--C 1.572 1.801 0 CA-C-N 119.895 1.847 . . . . 0.0 112.0 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.4 tt -71.19 137.64 48.89 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -174.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -125.59 176.43 6.87 Favored 'General case' 0 CA--C 1.571 1.78 0 N-CA-C 115.459 1.651 . . . . 0.0 115.459 -174.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.4 mp -110.11 -75.85 0.62 Allowed 'General case' 0 CA--C 1.577 1.993 0 N-CA-C 104.463 -2.421 . . . . 0.0 104.463 169.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -96.19 -178.65 4.39 Favored 'General case' 0 CA--C 1.584 2.264 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 172.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.8 m -86.82 -19.49 28.91 Favored 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 116.617 2.081 . . . . 0.0 116.617 174.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.33 13.91 1.07 Allowed 'General case' 0 CA--C 1.578 2.051 0 N-CA-C 117.539 2.422 . . . . 0.0 117.539 174.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -95.22 -27.25 15.61 Favored 'General case' 0 CA--C 1.568 1.641 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.2 m -80.44 166.72 20.97 Favored 'General case' 0 CA--C 1.58 2.113 0 CA-C-N 120.875 1.671 . . . . 0.0 113.803 177.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.9 mtpp -67.65 -59.77 3.07 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.432 -1.417 . . . . 0.0 108.358 172.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.2 p -82.74 100.13 10.08 Favored 'General case' 0 CA--C 1.57 1.718 0 N-CA-C 102.891 -3.003 . . . . 0.0 102.891 168.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -68.5 79.72 0.27 Allowed 'General case' 0 N--CA 1.498 1.972 0 CA-C-O 125.232 2.444 . . . . 0.0 116.233 -171.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 t -146.23 95.88 2.69 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-N 111.646 -2.525 . . . . 0.0 110.188 -174.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.3 t -93.95 123.75 37.52 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 107.138 -1.431 . . . . 0.0 107.138 171.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.1 tp60 -76.35 149.16 37.04 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 122.784 1.278 . . . . 0.0 110.427 174.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.24 155.5 20.83 Favored 'General case' 0 CA--C 1.574 1.873 1 N-CA-C 129.105 6.706 . . . . 0.0 129.105 -170.664 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -100.71 -34.34 9.89 Favored 'General case' 0 CA--C 1.578 2.024 0 CA-C-N 110.215 -3.175 . . . . 0.0 119.367 173.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.19 -55.43 3.68 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.415 -1.428 . . . . 0.0 113.79 -172.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 9.2 pt -76.81 -52.68 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.265 0 CA-C-N 120.48 1.491 . . . . 0.0 110.893 173.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.3 tt -95.88 118.72 33.06 Favored 'General case' 0 CA--C 1.565 1.555 0 N-CA-C 103.544 -2.762 . . . . 0.0 103.544 171.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.4 p -91.21 61.74 4.58 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 118.726 2.861 . . . . 0.0 118.726 -172.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.7 tp -173.72 110.48 0.17 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 174.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.2 m -91.11 122.05 33.42 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 121.026 1.739 . . . . 0.0 111.72 -174.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -136.48 147.38 47.13 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-N 114.31 -1.314 . . . . 0.0 111.55 -172.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 89.4 m -65.49 135.58 55.34 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 118.278 -2.764 . . . . 0.0 111.357 174.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -134.02 -176.7 4.27 Favored 'General case' 0 CA--C 1.566 1.575 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -173.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -91.51 162.02 14.72 Favored 'General case' 0 CA--C 1.573 1.857 0 CA-C-O 122.524 1.155 . . . . 0.0 113.745 177.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -81.83 153.07 26.61 Favored 'General case' 0 CA--C 1.572 1.816 0 CA-C-O 121.529 0.681 . . . . 0.0 112.354 174.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.49 158.84 28.5 Favored 'General case' 0 CA--C 1.567 1.631 0 N-CA-C 115.332 1.604 . . . . 0.0 115.332 -176.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -118.21 174.2 6.36 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 114.383 -1.28 . . . . 0.0 111.897 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -48.96 133.96 17.48 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 116.795 2.146 . . . . 0.0 116.795 -172.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.9 m120 71.57 15.47 6.06 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 -174.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.1 t -113.7 152.61 30.23 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 120.778 -1.201 . . . . 0.0 111.766 174.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -64.72 136.9 57.44 Favored 'General case' 0 CA--C 1.568 1.64 0 CA-C-O 123.313 1.53 . . . . 0.0 112.777 174.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 24.6 p -136.26 143.25 44.16 Favored 'General case' 0 CA--C 1.562 1.409 0 CA-C-N 112.911 -1.95 . . . . 0.0 112.241 -177.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 72.5 m -77.83 99.53 5.97 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-O 122.098 0.952 . . . . 0.0 108.787 177.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -75.74 -47.14 27.24 Favored 'General case' 0 CA--C 1.567 1.626 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 -173.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -79.17 -40.27 31.3 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 176.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.2 p 58.96 164.18 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.091 0 CA-C-O 124.332 2.015 . . . . 0.0 114.367 -174.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.74 -166.53 1.73 Allowed 'General case' 0 CA--C 1.566 1.561 0 CA-C-O 123.466 1.603 . . . . 0.0 108.916 173.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -96.16 68.37 2.66 Favored 'General case' 0 CA--C 1.576 1.96 0 N-CA-C 104.962 -2.236 . . . . 0.0 104.962 171.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 178.0 -165.75 35.45 Favored Glycine 0 N--CA 1.484 1.887 0 N-CA-C 116.474 1.35 . . . . 0.0 116.474 -173.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 2.8 t -77.89 146.62 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 CA-C-O 122.257 1.027 . . . . 0.0 111.594 -171.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -110.34 137.01 48.64 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -172.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -61.44 -52.54 64.12 Favored 'General case' 0 CA--C 1.579 2.085 0 CA-C-N 114.075 -1.42 . . . . 0.0 111.846 173.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -140.71 109.08 5.83 Favored 'General case' 0 CA--C 1.566 1.578 0 N-CA-C 104.084 -2.562 . . . . 0.0 104.084 173.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 42.8 m -48.94 156.89 0.85 Allowed Pre-proline 0 CA--C 1.587 2.393 0 N-CA-C 118.027 2.602 . . . . 0.0 118.027 -177.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -60.25 170.84 3.64 Favored 'Trans proline' 0 CA--C 1.573 2.43 0 C-N-CA 122.678 2.252 . . . . 0.0 116.179 177.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 62.5 m -73.16 149.72 42.74 Favored 'General case' 0 CA--C 1.571 1.773 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -70.48 171.98 9.21 Favored 'General case' 0 CA--C 1.577 2.003 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 -58.94 112.95 1.85 Allowed 'General case' 0 CA--C 1.576 1.967 0 O-C-N 120.551 -1.343 . . . . 0.0 113.388 -177.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 112.84 -21.9 17.55 Favored Glycine 0 N--CA 1.496 2.659 0 N-CA-C 117.751 1.86 . . . . 0.0 117.751 -173.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.7 mp -111.5 148.75 32.5 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 119.521 1.66 . . . . 0.0 111.718 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.89 153.19 23.88 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 122.22 1.01 . . . . 0.0 113.106 -177.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 7.4 t -95.21 123.95 38.98 Favored 'General case' 0 CA--C 1.569 1.678 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.529 173.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 . . . . . 0 N--CA 1.506 2.371 0 O-C-N 119.936 -1.727 . . . . 0.0 111.404 178.236 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 . . . . . 0 CA--C 1.56 1.354 0 CA-C-O 122.337 1.065 . . . . 0.0 109.894 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -98.22 -178.7 32.94 Favored Glycine 0 N--CA 1.485 1.921 0 N-CA-C 115.456 0.943 . . . . 0.0 115.456 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 32.9 mm -108.9 140.9 25.75 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 171.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.8 m -69.7 124.47 24.05 Favored 'General case' 0 CA--C 1.566 1.561 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 174.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 78.8 m-70 -144.69 155.75 43.74 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 122.805 1.288 . . . . 0.0 112.19 175.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -96.58 139.07 33.2 Favored 'General case' 0 CA--C 1.567 1.603 0 O-C-N 121.096 -1.003 . . . . 0.0 111.208 175.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.499 1.994 0 CA-C-O 122.675 1.226 . . . . 0.0 108.447 -179.749 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.7 p30 . . . . . 0 CA--C 1.58 2.104 0 N-CA-C 117.01 2.226 . . . . 0.0 117.01 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.8 tp -107.16 127.42 53.49 Favored 'General case' 0 CA--C 1.575 1.918 0 O-C-N 118.96 -2.337 . . . . 0.0 112.502 -175.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -81.03 172.13 14.11 Favored 'General case' 0 CA--C 1.575 1.922 0 O-C-N 119.702 -1.874 . . . . 0.0 114.522 179.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -67.37 143.7 56.2 Favored 'General case' 0 CA--C 1.569 1.674 0 C-N-CA 123.973 0.909 . . . . 0.0 112.006 176.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 98.33 -1.8 59.02 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 117.352 1.701 . . . . 0.0 117.352 -173.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -112.36 149.26 32.73 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-N 118.943 1.372 . . . . 0.0 111.701 -178.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.4 tp -70.67 130.25 41.27 Favored 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -177.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 22.0 p -132.38 150.58 52.13 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.93 0.892 . . . . 0.0 112.79 -178.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.1 tp -84.29 -78.62 0.23 Allowed 'General case' 0 CA--C 1.57 1.728 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 172.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 -94.71 170.19 9.63 Favored 'General case' 0 CA--C 1.57 1.747 0 CA-C-N 120.012 1.278 . . . . 0.0 113.684 174.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.2 p -69.62 -15.33 63.18 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 171.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.6 40.96 0.31 Allowed 'General case' 0 CA--C 1.575 1.919 0 N-CA-C 116.467 2.025 . . . . 0.0 116.467 174.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -136.15 -40.76 0.66 Allowed 'General case' 0 CA--C 1.573 1.845 0 C-N-CA 125.954 1.702 . . . . 0.0 113.08 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 74.2 m -84.64 152.22 23.95 Favored 'General case' 0 CA--C 1.567 1.605 0 N-CA-C 115.837 1.792 . . . . 0.0 115.837 -178.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -59.92 -55.88 28.65 Favored 'General case' 0 N--CA 1.503 2.209 0 C-N-CA 124.55 1.14 . . . . 0.0 109.896 173.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.6 m -82.27 102.1 10.96 Favored 'General case' 0 CA--C 1.569 1.686 0 N-CA-C 102.58 -3.119 . . . . 0.0 102.58 168.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -71.03 78.26 0.66 Allowed 'General case' 0 CA--C 1.569 1.697 0 CA-C-O 124.095 1.902 . . . . 0.0 114.583 -171.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 47.0 t -152.6 97.78 2.29 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-N 113.338 -1.756 . . . . 0.0 111.538 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 13.5 t -83.82 111.38 19.15 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 104.979 -2.23 . . . . 0.0 104.979 171.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.6 124.63 40.65 Favored 'General case' 0 CA--C 1.557 1.238 0 CA-C-O 122.472 1.129 . . . . 0.0 111.642 -172.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 -80.33 137.58 36.59 Favored 'General case' 0 CA--C 1.568 1.664 0 CA-C-O 122.698 1.237 . . . . 0.0 113.905 -174.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -63.98 -24.91 67.9 Favored 'General case' 0 CA--C 1.58 2.127 0 N-CA-C 117.5 2.407 . . . . 0.0 117.5 173.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.334 40.3 p 124.33 95.97 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 128.991 2.916 . . . . 0.0 108.496 174.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.414 7.5 tp 56.64 -49.11 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 N-CA-C 118.751 2.871 . . . . 0.0 118.751 177.669 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.6 tp -78.87 90.37 4.71 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 122.102 2.228 . . . . 0.0 108.522 173.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.3 p -52.51 103.95 0.08 Allowed 'General case' 0 CA--C 1.575 1.912 1 N-CA-C 122.514 4.265 . . . . 0.0 122.514 -171.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.0 tp -146.3 83.05 1.61 Allowed 'General case' 0 CA--C 1.572 1.799 0 N-CA-C 101.772 -3.418 . . . . 0.0 101.772 171.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.8 m -98.14 144.58 27.46 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -171.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.9 ttp180 -134.09 138.8 45.52 Favored 'General case' 0 CA--C 1.567 1.602 0 C-N-CA 124.372 1.069 . . . . 0.0 110.16 -175.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 65.1 m -68.04 144.87 54.92 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 119.694 -1.879 . . . . 0.0 114.017 177.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.75 172.81 12.18 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-N 113.416 -1.72 . . . . 0.0 114.381 -173.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 33.2 tp -81.71 143.79 31.6 Favored 'General case' 0 CA--C 1.567 1.626 0 CA-C-O 122.411 1.1 . . . . 0.0 113.196 -175.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.1 ptpt -66.2 145.53 55.68 Favored 'General case' 0 CA--C 1.574 1.874 0 CA-C-O 122.033 0.921 . . . . 0.0 113.271 174.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.13 159.75 29.53 Favored 'General case' 0 CA--C 1.569 1.682 0 N-CA-C 117.681 2.474 . . . . 0.0 117.681 -172.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.9 mtt180 -124.65 170.72 10.68 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 112.876 -1.966 . . . . 0.0 111.528 -177.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -45.34 125.87 5.93 Favored 'General case' 0 CA--C 1.571 1.78 0 N-CA-C 116.555 2.057 . . . . 0.0 116.555 -174.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 75.68 18.27 2.21 Favored 'General case' 0 N--CA 1.506 2.353 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -173.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.8 t -110.27 149.15 30.58 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 120.356 -1.465 . . . . 0.0 112.392 175.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -71.76 119.81 16.47 Favored 'General case' 0 CA--C 1.57 1.749 0 C-N-CA 124.799 1.24 . . . . 0.0 111.28 -179.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -123.87 154.35 39.78 Favored 'General case' 0 CA--C 1.564 1.499 0 CA-C-O 123.305 1.526 . . . . 0.0 114.427 -174.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.3 t -93.65 109.55 21.18 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 171.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.0 10.13 3.11 Favored 'General case' 0 CA--C 1.582 2.203 0 N-CA-C 118.325 2.713 . . . . 0.0 118.325 -179.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 44.4 p90 -143.69 160.44 40.7 Favored 'General case' 0 CA--C 1.57 1.718 0 C-N-CA 126.47 1.908 . . . . 0.0 111.076 -173.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.7 p -131.2 136.52 48.34 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 122.675 1.226 . . . . 0.0 109.637 172.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -99.78 -136.74 0.3 Allowed 'General case' 0 CA--C 1.566 1.577 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 173.305 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -128.18 74.12 1.52 Allowed 'General case' 0 CA--C 1.568 1.667 0 N-CA-C 103.414 -2.81 . . . . 0.0 103.414 170.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 161.33 -146.2 11.94 Favored Glycine 0 N--CA 1.488 2.11 0 N-CA-C 117.294 1.678 . . . . 0.0 117.294 -175.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.0 t -91.35 147.18 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 CA-C-O 122.92 1.343 . . . . 0.0 112.52 -166.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -119.86 137.13 54.19 Favored 'General case' 0 CA--C 1.556 1.208 0 CA-C-O 122.349 1.071 . . . . 0.0 110.787 -174.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -76.08 -9.74 58.86 Favored 'General case' 0 CA--C 1.582 2.196 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 174.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 11.3 ptpt -163.91 125.01 2.26 Favored 'General case' 0 CA--C 1.567 1.608 0 N-CA-C 105.965 -1.865 . . . . 0.0 105.965 175.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 64.0 m -62.67 144.01 96.34 Favored Pre-proline 0 CA--C 1.589 2.474 0 N-CA-C 117.123 2.268 . . . . 0.0 117.123 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -56.93 170.44 1.45 Allowed 'Trans proline' 0 CA--C 1.575 2.552 0 C-N-CA 123.067 2.511 . . . . 0.0 117.148 174.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 60.3 m -77.18 163.68 26.34 Favored 'General case' 0 CA--C 1.578 2.045 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -74.63 173.03 11.01 Favored 'General case' 0 CA--C 1.578 2.036 0 N-CA-C 117.351 2.352 . . . . 0.0 117.351 -175.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 53.1 tpt85 -66.94 113.47 4.99 Favored 'General case' 0 CA--C 1.571 1.756 0 O-C-N 120.524 -1.36 . . . . 0.0 111.6 174.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.63 -0.3 59.51 Favored Glycine 0 N--CA 1.499 2.841 0 N-CA-C 118.262 2.065 . . . . 0.0 118.262 -173.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.9 tt -135.79 132.81 37.2 Favored 'General case' 0 CA--C 1.568 1.671 0 CA-C-N 119.401 1.6 . . . . 0.0 107.742 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.32 159.85 14.73 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 116.445 2.017 . . . . 0.0 116.445 -171.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.9 t -93.11 127.62 38.72 Favored 'General case' 0 CA--C 1.57 1.747 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.653 173.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 . . . . . 0 N--CA 1.501 2.086 0 O-C-N 119.813 -1.804 . . . . 0.0 110.329 178.152 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 122.741 1.258 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -142.02 -171.21 12.9 Favored Glycine 0 N--CA 1.48 1.58 0 CA-C-N 115.351 -0.841 . . . . 0.0 115.194 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 32.3 mm -114.4 137.24 48.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 174.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 64.5 m -67.87 125.95 27.9 Favored 'General case' 0 CA--C 1.568 1.637 0 O-C-N 120.903 -1.123 . . . . 0.0 113.349 174.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -143.22 156.97 44.87 Favored 'General case' 0 CA--C 1.561 1.394 0 CA-C-O 123.43 1.585 . . . . 0.0 111.662 175.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -98.23 108.55 21.28 Favored 'General case' 0 CA--C 1.563 1.478 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 174.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.5 2.029 0 CA-C-O 123.579 1.656 . . . . 0.0 111.81 -174.684 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 . . . . . 0 CA--C 1.573 1.848 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 17.8 tp -96.68 96.68 8.79 Favored 'General case' 0 CA--C 1.568 1.636 0 O-C-N 120.15 -1.594 . . . . 0.0 113.442 174.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -98.24 151.68 20.21 Favored 'General case' 0 CA--C 1.578 2.026 0 N-CA-C 106.101 -1.814 . . . . 0.0 106.101 166.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -81.21 102.6 10.44 Favored 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 104.125 -2.546 . . . . 0.0 104.125 171.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 128.57 26.87 0.92 Allowed Glycine 0 CA--C 1.546 2.004 0 CA-C-N 113.547 -1.661 . . . . 0.0 115.669 -172.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -93.35 105.62 17.67 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 119.886 1.843 . . . . 0.0 108.167 172.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 mp -72.56 104.54 3.89 Favored 'General case' 0 N--CA 1.493 1.725 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 175.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 2.5 p -111.47 173.05 6.53 Favored 'General case' 0 CA--C 1.563 1.447 0 N-CA-C 117.888 2.551 . . . . 0.0 117.888 -171.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.1 tp -94.46 -73.71 0.57 Allowed 'General case' 0 CA--C 1.579 2.058 0 N-CA-C 105.965 -1.865 . . . . 0.0 105.965 170.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -100.7 -165.0 1.16 Allowed 'General case' 0 CA--C 1.583 2.249 0 C-N-CA 125.217 1.407 . . . . 0.0 113.707 172.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.1 m -93.61 -0.24 56.25 Favored 'General case' 0 N--CA 1.504 2.237 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 173.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.18 11.16 1.98 Allowed 'General case' 0 CA--C 1.578 2.037 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 174.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -96.2 -33.39 12.04 Favored 'General case' 0 CA--C 1.587 2.389 0 C-N-CA 125.766 1.627 . . . . 0.0 111.598 172.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . 0.305 85.0 m -87.6 131.33 34.45 Favored 'General case' 0 CA--C 1.587 2.388 0 C-N-CA 125.477 1.511 . . . . 0.0 109.674 172.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -41.33 -50.99 3.74 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 121.676 3.954 . . . . 0.0 121.676 -171.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 100.0 p -80.09 -77.33 0.19 Allowed 'General case' 0 CA--C 1.569 1.682 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 174.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -178.11 78.36 0.02 OUTLIER 'General case' 0 CA--C 1.571 1.752 0 N-CA-C 104.147 -2.538 . . . . 0.0 104.147 172.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 40.6 t -142.1 59.8 1.47 Allowed 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 116.203 1.927 . . . . 0.0 116.203 -173.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.3 t -92.84 119.53 32.27 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 169.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.91 115.73 31.1 Favored 'General case' 0 CA--C 1.569 1.703 0 CA-C-O 123.415 1.579 . . . . 0.0 113.745 -171.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -87.91 118.04 27.18 Favored 'General case' 0 CA--C 1.565 1.55 0 C-N-CA 124.775 1.23 . . . . 0.0 111.201 -178.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -83.76 44.2 0.97 Allowed 'General case' 0 CA--C 1.584 2.255 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 176.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.412 0.7 OUTLIER 106.54 176.65 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.699 0 C-N-CA 128.842 2.857 . . . . 0.0 112.167 -174.808 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 28.1 mm -54.07 -67.54 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.527 0 O-C-N 119.532 -1.98 . . . . 0.0 115.296 -173.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 pp -97.68 49.97 1.04 Allowed 'General case' 0 N--CA 1.509 2.486 0 CA-C-N 120.517 1.508 . . . . 0.0 113.451 176.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.2 p -102.33 -3.52 27.02 Favored 'General case' 0 N--CA 1.492 1.663 1 N-CA-C 121.906 4.039 . . . . 0.0 121.906 -172.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 21.7 tp 70.6 120.16 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.174 0 CA-C-N 120.288 1.403 . . . . 0.0 109.566 -173.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.7 m -94.78 124.63 38.93 Favored 'General case' 0 CA--C 1.561 1.386 0 O-C-N 120.377 -1.452 . . . . 0.0 114.741 -172.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.3 ttt85 -132.1 134.21 45.2 Favored 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 124.43 1.092 . . . . 0.0 110.283 -175.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 89.3 m -70.35 151.04 45.68 Favored 'General case' 0 CA--C 1.56 1.355 0 O-C-N 119.511 -1.993 . . . . 0.0 114.224 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.29 -174.21 3.88 Favored 'General case' 0 CA--C 1.565 1.531 0 CA-C-N 113.031 -1.895 . . . . 0.0 113.374 -173.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.5 mt -79.58 149.4 31.39 Favored 'General case' 0 CA--C 1.57 1.737 0 CA-C-O 122.225 1.012 . . . . 0.0 112.191 175.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -69.35 153.25 43.89 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 175.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.07 151.51 40.15 Favored 'General case' 0 CA--C 1.57 1.743 0 CA-C-O 124.242 1.972 . . . . 0.0 113.941 -174.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -118.99 168.41 10.83 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-N 113.427 -1.715 . . . . 0.0 110.968 -175.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -53.1 120.9 6.47 Favored 'General case' 0 CA--C 1.571 1.774 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -173.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 79.48 25.53 0.42 Allowed 'General case' 0 N--CA 1.505 2.317 0 C-N-CA 125.439 1.496 . . . . 0.0 113.789 -172.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.7 t -126.61 154.1 44.42 Favored 'General case' 0 CA--C 1.567 1.618 0 O-C-N 120.378 -1.451 . . . . 0.0 110.492 174.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -64.59 130.84 45.19 Favored 'General case' 0 CA--C 1.574 1.883 0 N-CA-C 116.764 2.135 . . . . 0.0 116.764 -173.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 24.5 p -141.04 141.99 34.25 Favored 'General case' 0 CA--C 1.563 1.47 0 CA-C-N 113.112 -1.858 . . . . 0.0 113.099 177.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.5 t -87.01 134.39 33.49 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 170.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.43 -26.16 62.63 Favored 'General case' 0 CA--C 1.578 2.027 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 -177.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -127.46 157.37 40.24 Favored 'General case' 0 CA--C 1.572 1.801 0 C-N-CA 125.448 1.499 . . . . 0.0 107.897 172.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 17.6 p -129.24 160.46 32.88 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 124.146 1.927 . . . . 0.0 110.308 172.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.288 0.7 OUTLIER -96.49 -121.99 0.12 Allowed 'General case' 0 CA--C 1.575 1.917 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 174.347 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.37 3.15 2.56 Favored 'General case' 0 CA--C 1.589 2.452 0 O-C-N 119.62 -1.925 . . . . 0.0 112.622 171.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -99.85 -162.12 28.83 Favored Glycine 0 N--CA 1.481 1.675 0 O-C-N 120.557 -1.339 . . . . 0.0 113.403 -175.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.9 t -79.41 137.42 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 CA-C-O 123.093 1.425 . . . . 0.0 109.86 -175.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -111.58 140.25 46.35 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -171.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -71.99 -1.73 15.62 Favored 'General case' 0 CA--C 1.587 2.389 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 174.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.3 123.62 0.97 Allowed 'General case' 0 CA--C 1.574 1.883 0 C-N-CA 127.879 2.472 . . . . 0.0 107.104 -174.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 36.2 m -70.73 129.07 90.27 Favored Pre-proline 0 CA--C 1.594 2.661 0 O-C-N 118.973 -2.33 . . . . 0.0 111.032 173.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -76.41 76.5 3.91 Favored 'Trans proline' 0 CA--C 1.573 2.427 0 N-CA-C 119.236 2.745 . . . . 0.0 119.236 -172.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 58.5 m 60.4 145.39 0.01 OUTLIER 'General case' 0 CA--C 1.578 2.041 0 N-CA-C 116.998 2.222 . . . . 0.0 116.998 174.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -65.78 162.01 19.65 Favored 'General case' 0 CA--C 1.578 2.038 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 174.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -63.02 109.28 1.43 Allowed 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.768 -1.207 . . . . 0.0 112.503 -177.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 112.92 -23.39 14.57 Favored Glycine 0 N--CA 1.498 2.812 0 N-CA-C 117.606 1.802 . . . . 0.0 117.606 -173.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.3 tp -99.1 143.22 29.62 Favored 'General case' 0 CA--C 1.572 1.79 0 CA-C-N 118.509 1.154 . . . . 0.0 111.625 -178.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -98.54 159.11 15.17 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.472 -1.393 . . . . 0.0 114.087 -174.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 10.4 t -93.8 123.7 37.31 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.687 172.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 . . . . . 0 N--CA 1.489 1.51 0 O-C-N 120.711 -1.243 . . . . 0.0 108.782 176.266 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 . . . . . 0 CA--C 1.571 1.786 0 CA-C-O 122.027 0.918 . . . . 0.0 112.883 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.65 -179.2 3.23 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 118.518 2.167 . . . . 0.0 118.518 178.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 39.3 mm -126.32 139.2 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.283 -1.128 . . . . 0.0 110.461 -174.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 59.7 m -69.11 128.35 36.33 Favored 'General case' 0 CA--C 1.57 1.717 0 O-C-N 120.291 -1.506 . . . . 0.0 114.464 174.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -141.7 158.99 43.13 Favored 'General case' 0 CA--C 1.565 1.547 0 CA-C-O 123.309 1.528 . . . . 0.0 111.922 175.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -97.65 128.14 44.13 Favored 'General case' 0 CA--C 1.562 1.433 0 CA-C-O 122.669 1.223 . . . . 0.0 111.385 178.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 12.3 p . . . . . 0 N--CA 1.493 1.718 0 CA-C-O 123.044 1.402 . . . . 0.0 109.093 177.418 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.3 0.5 OUTLIER . . . . . 0 N--CA 1.5 2.045 0 N-CA-C 116.952 2.204 . . . . 0.0 116.952 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.5 tp -129.77 126.21 37.62 Favored 'General case' 0 CA--C 1.574 1.895 0 C-N-CA 124.49 1.116 . . . . 0.0 108.934 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -80.31 167.34 20.38 Favored 'General case' 0 CA--C 1.573 1.862 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -174.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -63.72 138.15 58.37 Favored 'General case' 0 CA--C 1.572 1.815 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -176.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.81 -11.33 38.25 Favored Glycine 0 N--CA 1.496 2.653 0 N-CA-C 118.391 2.116 . . . . 0.0 118.391 -175.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 82.3 mm-40 -100.21 137.42 38.67 Favored 'General case' 0 CA--C 1.564 1.506 0 CA-C-N 118.99 1.395 . . . . 0.0 111.081 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 77.7 mt -67.45 134.3 51.14 Favored 'General case' 0 CA--C 1.573 1.853 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -174.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.5 p -122.97 177.84 5.32 Favored 'General case' 0 CA--C 1.573 1.849 0 CA-C-O 123.029 1.395 . . . . 0.0 113.408 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.9 mt -109.45 -74.41 0.66 Allowed 'General case' 0 CA--C 1.574 1.889 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 171.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.1 p30 -91.39 -173.23 3.53 Favored 'General case' 0 CA--C 1.581 2.154 0 C-N-CA 124.607 1.163 . . . . 0.0 113.181 172.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.8 t -94.4 -4.94 47.49 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 116.921 2.193 . . . . 0.0 116.921 174.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.44 1.87 15.24 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 117.382 2.364 . . . . 0.0 117.382 174.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -95.27 -20.92 18.78 Favored 'General case' 0 CA--C 1.57 1.717 0 N-CA-C 115.966 1.839 . . . . 0.0 115.966 -175.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.0 m -81.44 -131.72 0.03 OUTLIER 'General case' 0 CA--C 1.579 2.074 0 CA-C-N 121.236 1.834 . . . . 0.0 114.124 -175.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -72.73 -82.8 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.354 0 O-C-N 119.423 -2.048 . . . . 0.0 111.328 -177.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.6 p -88.79 -63.07 1.35 Allowed 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 121.966 0.889 . . . . 0.0 110.744 172.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -170.05 84.81 0.12 Allowed 'General case' 0 CA--C 1.569 1.706 0 N-CA-C 105.159 -2.163 . . . . 0.0 105.159 178.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 41.9 t -155.32 94.44 1.61 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 119.825 -1.797 . . . . 0.0 115.118 -176.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.8 t -114.81 139.39 49.77 Favored 'General case' 0 CA--C 1.56 1.364 0 CA-C-O 121.759 0.79 . . . . 0.0 108.988 171.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.46 124.61 29.06 Favored 'General case' 0 CA--C 1.573 1.837 0 CA-C-O 122.106 0.955 . . . . 0.0 109.124 174.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -27.45 4.93 0.0 OUTLIER 'General case' 0 CA--C 1.592 2.586 3 N-CA-C 142.845 11.794 . . . . 0.0 142.845 -166.852 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . 0.261 1.3 p30 -24.65 72.49 0.0 OUTLIER 'General case' 0 N--CA 1.531 3.592 2 CA-C-N 131.633 6.56 . . . . 0.0 125.005 -167.732 . . . . . . . . 3 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.4 t -139.85 14.74 2.49 Favored 'General case' 0 CA--C 1.583 2.235 0 CA-C-N 114.05 -1.432 . . . . 0.0 113.957 173.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.0 pt -140.12 -59.04 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 CA-C-N 120.054 1.297 . . . . 0.0 111.535 174.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 93.8 mt -131.86 -68.22 0.65 Allowed 'General case' 0 N--CA 1.498 1.936 0 CA-C-N 120.513 1.506 . . . . 0.0 113.171 -174.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.7 p -90.01 163.95 14.71 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 -174.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.6 tp -66.98 163.02 20.71 Favored 'General case' 0 CA--C 1.584 2.282 0 O-C-N 121.517 -0.739 . . . . 0.0 111.9 173.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.1 m -91.96 127.62 37.5 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 119.885 -1.759 . . . . 0.0 111.732 -172.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -111.66 154.51 24.82 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.86 174.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 55.7 m -63.57 151.5 41.35 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 118.751 -2.468 . . . . 0.0 112.099 174.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . 0.275 . . -133.82 -172.64 3.03 Favored 'General case' 0 CA--C 1.567 1.612 0 CA-C-N 113.123 -1.853 . . . . 0.0 110.663 -175.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 94.4 mt -125.0 150.42 46.72 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.856 -1.152 . . . . 0.0 112.008 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -63.9 144.03 57.39 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.383 -0.823 . . . . 0.0 111.456 173.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.96 147.03 35.13 Favored 'General case' 0 CA--C 1.566 1.586 0 CA-C-O 124.678 2.18 . . . . 0.0 116.246 -173.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -101.56 170.27 8.3 Favored 'General case' 0 CA--C 1.56 1.336 0 CA-C-N 111.449 -2.614 . . . . 0.0 111.161 -178.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -59.26 124.26 19.4 Favored 'General case' 0 CA--C 1.57 1.741 0 O-C-N 120.84 -1.162 . . . . 0.0 112.851 -175.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 83.21 22.01 0.17 Allowed 'General case' 0 N--CA 1.506 2.359 0 C-N-CA 125.602 1.561 . . . . 0.0 113.859 -172.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.4 t -121.28 150.1 41.91 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.059 -1.651 . . . . 0.0 111.657 174.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -69.08 141.7 54.66 Favored 'General case' 0 CA--C 1.57 1.713 0 CA-C-O 123.305 1.526 . . . . 0.0 113.391 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 8.5 p -140.33 148.81 41.91 Favored 'General case' 0 CA--C 1.564 1.514 0 CA-C-N 113.127 -1.851 . . . . 0.0 113.387 -175.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.5 p -77.26 110.51 12.03 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 120.878 -1.138 . . . . 0.0 108.421 173.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -76.3 20.23 0.22 Allowed 'General case' 0 CA--C 1.576 1.963 0 N-CA-C 120.46 3.504 . . . . 0.0 120.46 -172.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -158.1 -56.47 0.07 Allowed 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 124.869 1.268 . . . . 0.0 113.348 -174.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.8 p 72.29 147.12 0.08 Allowed 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 127.607 2.363 . . . . 0.0 113.702 -174.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -100.06 -139.24 0.32 Allowed 'General case' 0 CA--C 1.576 1.956 0 CA-C-N 113.143 -1.844 . . . . 0.0 107.04 172.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -136.78 68.82 1.42 Allowed 'General case' 0 CA--C 1.567 1.625 0 CA-C-O 123.796 1.76 . . . . 0.0 107.921 169.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -177.66 -156.96 17.52 Favored Glycine 0 CA--C 1.544 1.858 0 CA-C-N 113.781 -1.554 . . . . 0.0 111.522 -176.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 1.2 t -75.17 154.47 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.213 0 O-C-N 121.283 -1.127 . . . . 0.0 112.928 -171.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -123.11 139.1 54.41 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 116.581 2.067 . . . . 0.0 116.581 -171.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -68.71 -38.88 80.59 Favored 'General case' 0 N--CA 1.502 2.128 0 N-CA-C 113.853 1.056 . . . . 0.0 113.853 172.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -143.01 109.14 5.24 Favored 'General case' 0 CA--C 1.563 1.479 0 N-CA-C 104.381 -2.451 . . . . 0.0 104.381 174.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 49.2 m -52.23 150.81 7.88 Favored Pre-proline 0 CA--C 1.588 2.415 0 N-CA-C 116.085 1.883 . . . . 0.0 116.085 178.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -63.25 166.28 15.21 Favored 'Trans proline' 0 CA--C 1.572 2.385 0 C-N-CA 122.308 2.005 . . . . 0.0 115.924 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 80.3 m -69.2 150.73 47.16 Favored 'General case' 0 CA--C 1.572 1.805 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 178.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -71.24 163.47 27.58 Favored 'General case' 0 CA--C 1.573 1.857 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 174.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -54.55 118.55 4.26 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 -174.243 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.04 -29.49 9.66 Favored Glycine 0 CA--C 1.556 2.648 0 CA-C-N 114.153 -1.385 . . . . 0.0 115.851 -172.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.9 mp -99.57 144.11 29.05 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-O 122.77 1.271 . . . . 0.0 112.115 -177.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -112.16 159.14 18.84 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 124.16 0.984 . . . . 0.0 112.607 -177.079 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 3.0 t -88.83 80.79 7.08 Favored 'General case' 0 CA--C 1.575 1.926 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 177.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 . . . . . 0 CA--C 1.569 1.675 0 O-C-N 120.932 -1.105 . . . . 0.0 113.307 -174.557 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 . . . . . 0 N--CA 1.498 1.928 0 CA-C-O 122.495 1.14 . . . . 0.0 111.977 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -78.74 163.92 50.1 Favored Glycine 0 N--CA 1.489 2.205 0 CA-C-N 115.762 -0.654 . . . . 0.0 114.595 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 35.2 mm -103.63 132.57 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 69.6 m -62.14 119.75 9.56 Favored 'General case' 0 CA--C 1.564 1.502 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 176.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -143.99 154.1 42.93 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-O 122.324 1.059 . . . . 0.0 110.82 175.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -92.89 87.51 5.83 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 123.761 1.744 . . . . 0.0 110.374 -174.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.4 t . . . . . 0 N--CA 1.493 1.679 0 CA-C-N 113.165 -1.834 . . . . 0.0 107.001 -174.765 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 71.7 m-80 . . . . . 0 CA--C 1.582 2.205 0 N-CA-C 118.015 2.598 . . . . 0.0 118.015 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 48.6 tp -103.27 142.82 33.54 Favored 'General case' 0 CA--C 1.58 2.107 0 O-C-N 119.734 -1.854 . . . . 0.0 109.178 173.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.86 179.68 7.7 Favored 'General case' 0 CA--C 1.572 1.798 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -174.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -74.4 168.47 19.63 Favored 'General case' 0 CA--C 1.575 1.916 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.97 13.63 74.28 Favored Glycine 0 CA--C 1.561 2.929 0 N-CA-C 117.13 1.612 . . . . 0.0 117.13 -172.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -117.91 143.27 46.48 Favored 'General case' 0 CA--C 1.567 1.609 0 C-N-CA 125.21 1.404 . . . . 0.0 110.504 -173.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.3 tt -71.94 131.11 42.5 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.872 -1.143 . . . . 0.0 111.271 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.54 ' SG ' ' O ' ' A' ' 19' ' ' ASN . 0.4 OUTLIER -135.96 154.25 51.16 Favored 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -173.751 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.5 mt -100.72 -67.56 0.85 Allowed 'General case' 0 CA--C 1.576 1.969 0 CA-C-N 113.622 -1.626 . . . . 0.0 108.983 171.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.54 ' O ' ' SG ' ' A' ' 17' ' ' CYS . 62.1 m-20 -108.18 -171.58 1.89 Allowed 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 120.776 1.625 . . . . 0.0 114.894 173.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.7 m -64.61 -30.69 71.71 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 118.92 -2.363 . . . . 0.0 113.769 172.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.31 43.34 1.01 Allowed 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 116.112 1.893 . . . . 0.0 116.112 173.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -117.7 -71.12 0.75 Allowed 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 102.281 -3.229 . . . . 0.0 102.281 171.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 34.7 m -84.89 81.04 9.06 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 103.437 -2.801 . . . . 0.0 103.437 167.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.7 mttm -66.76 5.92 0.56 Allowed 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 120.164 3.394 . . . . 0.0 120.164 -169.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.6 p -73.22 -72.93 0.23 Allowed 'General case' 0 CA--C 1.572 1.792 0 CA-C-O 118.613 -0.708 . . . . 0.0 109.14 171.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -166.68 14.44 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 115.981 1.845 . . . . 0.0 115.981 174.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 42.7 t -153.83 94.3 1.75 Allowed 'General case' 0 N--CA 1.499 2.019 0 CA-C-N 123.874 3.034 . . . . 0.0 117.973 -171.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 50.8 t -94.65 105.21 17.15 Favored 'General case' 0 CA--C 1.563 1.447 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 170.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.54 130.95 45.11 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 123.141 1.448 . . . . 0.0 112.824 -173.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 35.5 t60 -81.9 159.48 23.65 Favored 'General case' 0 CA--C 1.564 1.505 0 CA-C-O 122.815 1.293 . . . . 0.0 114.145 -174.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.3 p-10 -79.92 -51.42 9.12 Favored 'General case' 0 CA--C 1.57 1.717 0 CA-C-O 118.47 -0.776 . . . . 0.0 112.287 173.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -177.95 -65.37 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 124.589 1.156 . . . . 0.0 110.693 173.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 38.2 mm -133.01 -61.37 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 CA-C-N 121.042 1.746 . . . . 0.0 109.578 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.0 tp -71.06 102.4 2.45 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 120.192 1.36 . . . . 0.0 110.519 176.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 60.5 p -53.34 92.12 0.01 OUTLIER 'General case' 0 CA--C 1.573 1.856 1 N-CA-C 122.168 4.136 . . . . 0.0 122.168 -171.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 tt -125.5 87.03 2.63 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 101.865 -3.383 . . . . 0.0 101.865 171.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.7 m -99.98 136.39 39.96 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 -171.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -121.76 141.58 51.05 Favored 'General case' 0 CA--C 1.565 1.557 0 CA-C-N 114.707 -1.133 . . . . 0.0 108.347 174.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.7 m -79.55 146.31 32.69 Favored 'General case' 0 CA--C 1.556 1.174 0 O-C-N 119.492 -2.005 . . . . 0.0 113.831 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -135.64 -178.21 5.02 Favored 'General case' 0 CA--C 1.566 1.572 0 CA-C-N 113.841 -1.527 . . . . 0.0 113.996 -173.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.48 135.45 33.34 Favored 'General case' 0 CA--C 1.571 1.77 0 O-C-N 121.252 -0.905 . . . . 0.0 110.177 176.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.43 160.36 27.61 Favored 'General case' 0 CA--C 1.579 2.06 0 O-C-N 120.908 -1.12 . . . . 0.0 113.236 176.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.41 155.25 36.56 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 117.069 2.248 . . . . 0.0 117.069 -173.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 -117.18 175.77 5.45 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-N 112.889 -1.959 . . . . 0.0 110.696 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -58.38 128.1 35.45 Favored 'General case' 0 CA--C 1.57 1.748 0 O-C-N 120.651 -1.28 . . . . 0.0 113.631 -174.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 82.5 11.06 0.61 Allowed 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 125.748 1.619 . . . . 0.0 114.217 -173.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.7 t -110.36 147.16 34.5 Favored 'General case' 0 CA--C 1.563 1.458 0 O-C-N 120.143 -1.598 . . . . 0.0 111.988 175.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -80.11 110.56 15.63 Favored 'General case' 0 CA--C 1.57 1.734 0 CA-C-O 123.114 1.435 . . . . 0.0 112.449 -177.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.2 152.29 20.06 Favored 'General case' 0 CA--C 1.563 1.456 0 C-N-CA 125.926 1.69 . . . . 0.0 112.464 174.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.5 t -79.46 103.08 9.13 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 171.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.96 -38.51 69.76 Favored 'General case' 0 CA--C 1.566 1.562 0 N-CA-C 118.413 2.745 . . . . 0.0 118.413 -171.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.4 p90 -80.94 61.38 4.52 Favored 'General case' 0 CA--C 1.571 1.779 0 C-N-CA 124.728 1.211 . . . . 0.0 113.132 175.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.9 p -68.95 135.26 50.69 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 119.005 -2.309 . . . . 0.0 112.581 -174.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.307 0.5 OUTLIER -94.87 -135.32 0.2 Allowed 'General case' 0 CA--C 1.565 1.556 0 CA-C-N 111.551 -2.568 . . . . 0.0 107.272 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -139.45 73.57 1.44 Allowed 'General case' 0 CA--C 1.561 1.38 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 169.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -172.98 -140.6 3.2 Favored Glycine 0 N--CA 1.482 1.756 0 CA-C-N 115.3 -0.864 . . . . 0.0 113.333 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.4 t -87.56 142.98 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 CA-C-O 122.89 1.329 . . . . 0.0 111.139 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -117.85 132.66 56.41 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-O 122.515 1.15 . . . . 0.0 110.353 -174.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -62.21 -43.68 98.28 Favored 'General case' 0 CA--C 1.581 2.148 0 CA-C-N 115.604 -0.725 . . . . 0.0 112.913 174.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -137.1 110.91 8.15 Favored 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 103.46 -2.793 . . . . 0.0 103.46 172.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 51.3 m -51.4 152.68 4.26 Favored Pre-proline 0 CA--C 1.593 2.605 0 N-CA-C 116.911 2.189 . . . . 0.0 116.911 -176.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.62 -173.8 0.4 Allowed 'Trans proline' 0 CA--C 1.572 2.407 0 C-N-CA 122.851 2.368 . . . . 0.0 116.619 -174.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 70.2 m -80.08 155.62 27.45 Favored 'General case' 0 CA--C 1.573 1.834 0 O-C-N 120.427 -1.42 . . . . 0.0 113.56 -178.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.86 -178.8 2.0 Favored 'General case' 0 CA--C 1.578 2.055 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 -175.394 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.95 112.46 3.31 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.364 -1.46 . . . . 0.0 112.562 -175.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 86.55 29.26 24.77 Favored Glycine 0 CA--C 1.556 2.637 0 N-CA-C 117.435 1.734 . . . . 0.0 117.435 -173.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.9 tp -141.11 141.35 34.21 Favored 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 118.812 1.306 . . . . 0.0 111.083 -176.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.74 158.32 16.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.674 -1.266 . . . . 0.0 113.219 -176.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 4.3 t -91.09 95.35 10.04 Favored 'General case' 0 CA--C 1.575 1.933 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 173.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 . . . . . 0 N--CA 1.498 1.943 0 N-CA-C 118.561 2.8 . . . . 0.0 118.561 -171.074 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 . . . . . 0 N--CA 1.495 1.786 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -125.01 160.46 19.63 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 118.184 2.034 . . . . 0.0 118.184 -177.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.5 mm -91.96 129.57 42.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 O-C-N 120.989 -1.301 . . . . 0.0 109.675 -172.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.6 m -64.04 124.52 21.81 Favored 'General case' 0 CA--C 1.567 1.618 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 177.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 72.8 m-70 -143.8 161.37 38.8 Favored 'General case' 0 CA--C 1.565 1.55 0 CA-C-O 123.462 1.601 . . . . 0.0 111.988 175.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -98.08 131.47 44.45 Favored 'General case' 0 CA--C 1.563 1.448 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.145 175.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.7 t . . . . . 0 N--CA 1.5 2.039 0 CA-C-O 123.068 1.413 . . . . 0.0 108.566 -179.194 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.25 62.5 m-80 . . . . . 0 N--CA 1.502 2.149 0 CA-C-O 121.61 0.719 . . . . 0.0 110.297 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -139.98 158.15 44.53 Favored 'General case' 0 CA--C 1.573 1.841 0 CA-C-O 122.771 1.272 . . . . 0.0 110.987 173.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -79.69 162.13 25.39 Favored 'General case' 0 CA--C 1.566 1.588 0 N-CA-C 115.237 1.569 . . . . 0.0 115.237 -173.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -78.18 126.51 30.91 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-O 122.403 1.097 . . . . 0.0 109.741 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 114.91 19.09 6.12 Favored Glycine 0 CA--C 1.559 2.79 0 N-CA-C 116.019 1.168 . . . . 0.0 116.019 -172.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -135.08 149.97 50.16 Favored 'General case' 0 CA--C 1.569 1.693 0 CA-C-N 119.215 1.507 . . . . 0.0 111.181 -178.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mp -73.48 147.21 44.31 Favored 'General case' 0 CA--C 1.575 1.926 0 N-CA-C 114.093 1.146 . . . . 0.0 114.093 -178.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 4.0 p -135.73 -175.08 3.84 Favored 'General case' 0 CA--C 1.574 1.901 0 CA-C-O 122.767 1.27 . . . . 0.0 114.234 -174.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.5 mt -109.31 -76.96 0.6 Allowed 'General case' 0 CA--C 1.575 1.921 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 170.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.2 p30 -96.1 -178.43 4.33 Favored 'General case' 0 CA--C 1.584 2.267 0 N-CA-C 114.908 1.448 . . . . 0.0 114.908 172.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 t -85.42 -17.54 36.3 Favored 'General case' 0 N--CA 1.503 2.206 0 N-CA-C 117.358 2.355 . . . . 0.0 117.358 174.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.14 9.75 2.35 Favored 'General case' 0 CA--C 1.577 1.998 0 N-CA-C 116.771 2.138 . . . . 0.0 116.771 174.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -97.0 -31.44 12.52 Favored 'General case' 0 CA--C 1.567 1.611 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.7 m -68.7 170.48 9.31 Favored 'General case' 0 CA--C 1.581 2.171 0 CA-C-N 121.232 1.833 . . . . 0.0 113.586 174.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -65.85 -65.25 0.7 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.034 -1.666 . . . . 0.0 108.751 172.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 83.4 p -83.65 107.49 16.13 Favored 'General case' 0 CA--C 1.566 1.588 0 N-CA-C 102.866 -3.013 . . . . 0.0 102.866 168.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -66.15 79.29 0.09 Allowed 'General case' 0 N--CA 1.501 2.089 0 CA-C-O 124.746 2.212 . . . . 0.0 115.596 -171.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 36.4 t -143.19 89.77 2.13 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 112.083 -2.326 . . . . 0.0 111.22 174.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.2 t -86.78 114.57 23.56 Favored 'General case' 0 CA--C 1.555 1.163 0 N-CA-C 102.688 -3.079 . . . . 0.0 102.688 169.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -96.97 123.65 40.74 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-O 123.525 1.631 . . . . 0.0 112.34 -171.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -83.18 141.85 31.62 Favored 'General case' 0 CA--C 1.558 1.286 0 CA-C-N 114.079 -1.419 . . . . 0.0 113.865 -174.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -68.51 17.26 0.04 OUTLIER 'General case' 0 CA--C 1.586 2.353 0 N-CA-C 117.46 2.393 . . . . 0.0 117.46 172.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.263 42.8 p 65.54 65.99 0.54 Allowed 'General case' 0 N--CA 1.499 2.023 0 C-N-CA 126.103 1.761 . . . . 0.0 112.866 -177.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.336 13.4 mt 78.62 151.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.511 2.597 0 C-N-CA 125.188 1.395 . . . . 0.0 110.256 -179.1 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.8 tp 66.46 75.4 0.33 Allowed 'General case' 0 N--CA 1.51 2.571 0 O-C-N 120.197 -1.564 . . . . 0.0 108.587 -172.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.0 p -48.11 100.56 0.02 OUTLIER 'General case' 0 CA--C 1.574 1.885 1 N-CA-C 123.457 4.614 . . . . 0.0 123.457 -170.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 30.6 tp -132.42 82.79 2.03 Favored 'General case' 0 CA--C 1.572 1.79 0 N-CA-C 101.645 -3.465 . . . . 0.0 101.645 170.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.0 m -99.85 131.72 45.65 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 -171.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -135.48 136.12 41.02 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 123.976 0.91 . . . . 0.0 110.981 -174.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 60.6 m -63.25 136.64 57.83 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 119.873 -1.767 . . . . 0.0 112.985 176.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.86 179.78 6.66 Favored 'General case' 0 CA--C 1.565 1.533 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -173.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -76.45 164.44 25.98 Favored 'General case' 0 CA--C 1.571 1.759 0 CA-C-O 122.417 1.103 . . . . 0.0 113.962 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.91 163.14 28.59 Favored 'General case' 0 CA--C 1.567 1.612 0 N-CA-C 115.078 1.51 . . . . 0.0 115.078 179.039 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.03 142.84 32.98 Favored 'General case' 0 CA--C 1.564 1.489 0 CA-C-O 123.822 1.772 . . . . 0.0 113.434 177.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -96.65 164.14 12.71 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-N 113.739 -1.573 . . . . 0.0 112.173 -174.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -53.98 123.97 14.14 Favored 'General case' 0 CA--C 1.571 1.772 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -174.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 84.6 18.77 0.15 Allowed 'General case' 0 N--CA 1.508 2.444 0 C-N-CA 126.056 1.742 . . . . 0.0 113.949 -172.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.9 t -119.95 150.82 39.89 Favored 'General case' 0 CA--C 1.566 1.591 0 O-C-N 120.203 -1.56 . . . . 0.0 112.211 174.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -67.13 141.14 57.51 Favored 'General case' 0 CA--C 1.57 1.738 0 CA-C-O 122.886 1.327 . . . . 0.0 114.315 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -129.44 139.09 51.74 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-N 113.861 -1.518 . . . . 0.0 112.811 -176.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.8 t -87.82 85.56 7.05 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-O 122.171 0.986 . . . . 0.0 109.981 174.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.48 -33.05 64.63 Favored 'General case' 0 CA--C 1.571 1.752 0 N-CA-C 119.479 3.14 . . . . 0.0 119.479 -173.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -78.8 153.93 30.31 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 125.502 1.521 . . . . 0.0 112.915 174.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.1 p -112.44 125.4 54.17 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 123.338 1.542 . . . . 0.0 109.8 172.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -99.64 -159.41 0.74 Allowed 'General case' 0 CA--C 1.576 1.972 0 CA-C-N 112.655 -2.066 . . . . 0.0 106.738 171.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -112.49 64.42 0.63 Allowed 'General case' 0 N--CA 1.5 2.049 0 O-C-N 119.634 -1.916 . . . . 0.0 106.109 171.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 178.89 -165.83 35.1 Favored Glycine 0 CA--C 1.542 1.757 0 CA-C-N 113.724 -1.58 . . . . 0.0 114.872 -173.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.4 t -92.87 156.23 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 CA-C-O 123.314 1.531 . . . . 0.0 113.171 -166.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 17.6 m-30 -106.44 140.76 38.84 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 114.797 -1.092 . . . . 0.0 113.742 -176.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -71.58 -59.16 2.9 Favored 'General case' 0 CA--C 1.575 1.911 0 O-C-N 121.23 -0.919 . . . . 0.0 113.051 175.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.96 119.62 30.95 Favored 'General case' 0 CA--C 1.567 1.621 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 174.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 55.1 m -49.46 153.34 1.92 Allowed Pre-proline 0 CA--C 1.588 2.432 0 N-CA-C 120.064 3.357 . . . . 0.0 120.064 -177.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -58.23 169.47 2.9 Favored 'Trans proline' 0 CA--C 1.573 2.453 0 C-N-CA 123.216 2.611 . . . . 0.0 115.573 172.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 2.7 m -94.02 107.16 19.1 Favored 'General case' 0 CA--C 1.577 1.985 0 O-C-N 120.397 -1.439 . . . . 0.0 109.19 175.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.401 0.0 OUTLIER -83.86 -63.16 1.4 Allowed 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 120.961 3.689 . . . . 0.0 120.961 -171.32 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.89 82.11 7.65 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.245 -1.535 . . . . 0.0 114.957 -173.229 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 71.24 33.26 64.85 Favored Glycine 0 N--CA 1.495 2.616 0 N-CA-C 119.339 2.495 . . . . 0.0 119.339 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.4 mp -122.33 143.98 49.29 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 122.51 1.147 . . . . 0.0 111.464 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.63 155.82 17.86 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 122.227 1.013 . . . . 0.0 112.55 177.325 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 3.5 t -94.88 86.99 4.83 Favored 'General case' 0 CA--C 1.575 1.941 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.421 175.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 . . . . . 0 N--CA 1.492 1.668 0 O-C-N 120.514 -1.366 . . . . 0.0 112.98 -173.556 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 . . . . . 0 CA--C 1.57 1.745 0 CA-C-O 121.913 0.864 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -89.95 155.24 24.42 Favored Glycine 0 N--CA 1.499 2.867 0 O-C-N 120.922 -1.111 . . . . 0.0 114.614 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 29.5 mm -94.45 130.83 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 120.232 -1.746 . . . . 0.0 110.931 -170.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 95.8 m -61.11 120.53 10.48 Favored 'General case' 0 CA--C 1.566 1.576 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 175.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -144.52 143.54 30.9 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 122.481 1.134 . . . . 0.0 110.617 174.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -95.67 77.32 3.28 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 124.279 1.99 . . . . 0.0 111.792 -174.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.9 m . . . . . 0 CA--C 1.577 1.991 0 N-CA-C 117.161 2.282 . . . . 0.0 117.161 -177.714 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 . . . . . 0 N--CA 1.494 1.758 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.2 tp -154.05 118.63 4.91 Favored 'General case' 0 CA--C 1.574 1.895 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 175.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -74.04 164.82 26.14 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -173.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 mp0 -69.86 132.84 46.64 Favored 'General case' 0 CA--C 1.567 1.604 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.891 -174.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.04 -10.29 51.46 Favored Glycine 0 N--CA 1.497 2.703 0 N-CA-C 117.18 1.632 . . . . 0.0 117.18 -173.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -99.23 144.11 28.73 Favored 'General case' 0 CA--C 1.566 1.569 0 CA-C-N 118.983 1.392 . . . . 0.0 110.843 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.5 mp -67.29 136.21 54.53 Favored 'General case' 0 CA--C 1.575 1.915 0 N-CA-C 113.904 1.075 . . . . 0.0 113.904 -175.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 11.7 p -137.92 144.57 41.34 Favored 'General case' 0 CA--C 1.565 1.522 0 C-N-CA 124.034 0.934 . . . . 0.0 112.122 -177.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 78.1 mt -82.99 -66.1 0.93 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.253 -0.904 . . . . 0.0 112.155 176.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -98.76 165.33 11.84 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 120.002 1.274 . . . . 0.0 113.198 174.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -74.92 -13.4 60.53 Favored 'General case' 0 N--CA 1.506 2.371 0 N-CA-C 116.301 1.963 . . . . 0.0 116.301 172.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.55 30.79 0.41 Allowed 'General case' 0 CA--C 1.58 2.098 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 172.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -127.95 -23.76 3.3 Favored 'General case' 0 CA--C 1.571 1.751 0 CA-C-O 116.767 -1.587 . . . . 0.0 114.863 -175.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 57.0 m -73.31 -144.99 0.02 OUTLIER 'General case' 0 CA--C 1.587 2.402 0 CA-C-N 122.23 2.287 . . . . 0.0 113.254 176.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -83.57 -67.64 0.77 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 118.759 -2.463 . . . . 0.0 114.233 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 61.9 p -84.66 -74.21 0.4 Allowed 'General case' 0 CA--C 1.566 1.584 0 O-C-N 121.248 -0.908 . . . . 0.0 111.235 174.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.5 t-20 -172.76 77.8 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 C-N-CA 124.731 1.212 . . . . 0.0 109.521 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.8 t -160.29 98.04 1.26 Allowed 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 121.259 1.845 . . . . 0.0 115.798 173.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.8 t -101.11 117.43 34.99 Favored 'General case' 0 CA--C 1.562 1.405 0 N-CA-C 103.046 -2.946 . . . . 0.0 103.046 169.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 65.1 tp60 -94.94 113.09 24.76 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.363 1.065 . . . . 0.0 113.739 -173.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -81.85 135.01 35.46 Favored 'General case' 0 CA--C 1.56 1.361 0 CA-C-N 114.741 -1.118 . . . . 0.0 111.119 176.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.4 p-10 -73.09 -75.53 0.14 Allowed 'General case' 0 CA--C 1.574 1.885 0 CA-C-O 118.326 -0.845 . . . . 0.0 113.043 174.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.5 t -169.5 92.6 0.25 Allowed 'General case' 0 N--CA 1.502 2.142 0 CA-C-N 120.906 1.685 . . . . 0.0 111.51 -177.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.305 3.8 mp 70.65 -69.06 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 C-N-CA 125.427 1.491 . . . . 0.0 111.348 174.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.4 mp -69.08 109.56 4.07 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 120.304 1.411 . . . . 0.0 107.697 173.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 56.7 p -72.2 83.57 1.02 Allowed 'General case' 0 CA--C 1.567 1.617 0 N-CA-C 120.502 3.519 . . . . 0.0 120.502 -171.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.7 tp -104.99 81.13 1.7 Allowed 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 103.305 -2.85 . . . . 0.0 103.305 170.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 26.9 m -100.58 124.17 45.79 Favored 'General case' 0 CA--C 1.564 1.495 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -170.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 65.6 mtt85 -114.33 167.85 10.35 Favored 'General case' 0 N--CA 1.501 2.102 0 C-N-CA 124.05 0.94 . . . . 0.0 111.601 174.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 83.4 m -79.95 147.86 31.44 Favored 'General case' 0 CA--C 1.568 1.649 0 O-C-N 118.565 -2.584 . . . . 0.0 111.104 172.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.91 172.43 12.7 Favored 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 -174.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.1 mt -85.25 152.67 23.14 Favored 'General case' 0 CA--C 1.568 1.663 0 CA-C-O 122.2 1.0 . . . . 0.0 113.034 -178.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -64.88 146.31 55.08 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 178.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.91 155.11 33.05 Favored 'General case' 0 CA--C 1.564 1.504 0 CA-C-O 123.398 1.571 . . . . 0.0 114.848 -175.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -108.33 172.66 6.71 Favored 'General case' 0 CA--C 1.562 1.422 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.448 -174.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -52.7 126.72 20.78 Favored 'General case' 0 CA--C 1.572 1.814 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 -174.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 74.51 20.11 2.55 Favored 'General case' 0 N--CA 1.506 2.347 0 N-CA-C 114.858 1.429 . . . . 0.0 114.858 -173.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 37.3 t -115.41 153.37 31.18 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 120.524 -1.36 . . . . 0.0 111.188 174.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -64.46 136.92 57.55 Favored 'General case' 0 CA--C 1.57 1.722 0 CA-C-O 123.18 1.467 . . . . 0.0 113.017 176.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 17.0 p -138.19 139.96 39.56 Favored 'General case' 0 CA--C 1.559 1.312 0 CA-C-N 113.194 -1.821 . . . . 0.0 112.436 -176.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.1 t -75.14 90.39 2.53 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 122.991 1.377 . . . . 0.0 110.704 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -76.56 -51.04 12.41 Favored 'General case' 0 CA--C 1.568 1.65 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 -173.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 54.0 p90 -79.25 -37.26 38.38 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 117.193 2.294 . . . . 0.0 117.193 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 80.4 p 62.84 144.04 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 127.034 2.134 . . . . 0.0 114.644 -174.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.23 -168.36 1.55 Allowed 'General case' 0 CA--C 1.567 1.632 0 CA-C-N 113.934 -1.485 . . . . 0.0 108.436 171.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -103.42 74.3 1.26 Allowed 'General case' 0 CA--C 1.567 1.62 0 N-CA-C 105.191 -2.152 . . . . 0.0 105.191 171.049 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 166.42 -160.18 33.68 Favored Glycine 0 N--CA 1.482 1.701 0 CA-C-O 122.388 0.993 . . . . 0.0 115.079 -174.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 13.3 t -83.91 143.98 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 CA-C-O 122.935 1.35 . . . . 0.0 112.32 -167.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -109.24 135.18 50.76 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.916 -174.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -74.51 -17.58 60.73 Favored 'General case' 0 CA--C 1.589 2.447 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 173.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm -147.67 119.21 7.94 Favored 'General case' 0 CA--C 1.572 1.817 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 174.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 74.4 m -55.51 151.11 21.79 Favored Pre-proline 0 CA--C 1.586 2.357 0 N-CA-C 117.366 2.358 . . . . 0.0 117.366 177.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -66.79 172.88 8.89 Favored 'Trans proline' 0 CA--C 1.576 2.61 0 C-N-CA 122.464 2.109 . . . . 0.0 115.623 174.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 34.1 m -74.7 154.67 38.34 Favored 'General case' 0 CA--C 1.579 2.065 0 O-C-N 120.63 -1.294 . . . . 0.0 114.481 -178.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.41 179.15 7.85 Favored 'General case' 0 CA--C 1.576 1.957 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 179.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -65.81 103.44 0.9 Allowed 'General case' 0 CA--C 1.572 1.813 0 O-C-N 120.49 -1.381 . . . . 0.0 113.02 -176.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 129.79 -45.68 1.12 Allowed Glycine 0 N--CA 1.494 2.559 0 CA-C-N 115.224 -0.898 . . . . 0.0 114.816 -173.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mp -93.75 139.44 30.84 Favored 'General case' 0 CA--C 1.562 1.411 0 CA-C-O 122.707 1.242 . . . . 0.0 111.338 -176.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.32 151.24 21.28 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 121.787 0.803 . . . . 0.0 112.414 -177.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.8 t -92.13 124.36 36.16 Favored 'General case' 0 CA--C 1.567 1.621 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.527 173.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 . . . . . 0 N--CA 1.492 1.643 0 O-C-N 120.702 -1.249 . . . . 0.0 107.672 -176.555 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 . . . . . 0 N--CA 1.493 1.686 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.12 -179.26 52.53 Favored Glycine 0 N--CA 1.493 2.454 0 O-C-N 121.786 -0.571 . . . . 0.0 113.677 172.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.0 mm -115.59 137.08 50.35 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.536 0 CA-C-N 119.455 1.627 . . . . 0.0 111.62 -174.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.0 m -69.56 126.83 30.92 Favored 'General case' 0 CA--C 1.569 1.696 0 O-C-N 120.813 -1.179 . . . . 0.0 114.179 174.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -141.33 156.05 45.88 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 122.905 1.336 . . . . 0.0 111.115 176.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -93.68 77.11 4.31 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-O 124.097 1.903 . . . . 0.0 111.629 -174.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 93.0 t . . . . . 0 N--CA 1.496 1.826 0 CA-C-N 112.246 -2.252 . . . . 0.0 109.04 -177.322 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 . . . . . 0 CA--C 1.581 2.15 0 N-CA-C 120.844 3.646 . . . . 0.0 120.844 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.4 tp -127.81 127.29 43.26 Favored 'General case' 0 CA--C 1.58 2.106 0 O-C-N 120.679 -1.263 . . . . 0.0 108.985 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -76.13 158.73 31.43 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 119.961 -1.712 . . . . 0.0 114.895 -174.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.26 136.22 54.59 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 122.028 0.918 . . . . 0.0 111.216 176.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.96 -7.85 67.56 Favored Glycine 0 CA--C 1.557 2.69 0 N-CA-C 116.558 1.383 . . . . 0.0 116.558 -172.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -97.66 142.72 29.12 Favored 'General case' 0 CA--C 1.567 1.599 0 CA-C-N 119.026 1.413 . . . . 0.0 110.167 178.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.4 mp -63.99 128.09 34.28 Favored 'General case' 0 CA--C 1.573 1.835 0 CA-C-O 122.14 0.971 . . . . 0.0 112.455 -178.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -129.11 157.85 40.6 Favored 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 123.741 1.734 . . . . 0.0 113.57 -173.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.3 mt -102.76 -64.97 1.02 Allowed 'General case' 0 CA--C 1.573 1.849 0 CA-C-N 114.269 -1.332 . . . . 0.0 107.598 170.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -98.97 148.83 23.59 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.8 t -68.29 -22.65 64.72 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 119.819 -1.801 . . . . 0.0 112.842 169.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . 0.3 . . -71.68 3.4 4.09 Favored 'General case' 0 CA--C 1.58 2.121 0 N-CA-C 115.725 1.75 . . . . 0.0 115.725 171.154 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -99.83 -37.52 9.03 Favored 'General case' 0 CA--C 1.575 1.928 0 C-N-CA 126.05 1.74 . . . . 0.0 113.206 173.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 12.5 m -76.46 157.37 32.27 Favored 'General case' 0 CA--C 1.572 1.795 0 N-CA-C 116.507 2.04 . . . . 0.0 116.507 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -68.54 -59.65 2.99 Favored 'General case' 0 N--CA 1.501 2.084 0 C-N-CA 124.307 1.043 . . . . 0.0 109.016 172.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.7 t -81.52 104.38 11.9 Favored 'General case' 0 CA--C 1.565 1.534 0 N-CA-C 103.0 -2.963 . . . . 0.0 103.0 168.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -70.88 82.01 0.65 Allowed 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 124.528 2.109 . . . . 0.0 113.071 -172.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 28.8 t -155.92 81.56 1.01 Allowed 'General case' 0 CA--C 1.56 1.336 0 CA-C-N 112.157 -2.292 . . . . 0.0 109.99 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.0 t -78.84 114.2 17.57 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 104.785 -2.302 . . . . 0.0 104.785 172.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.03 109.27 16.21 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -171.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -77.35 108.37 10.44 Favored 'General case' 0 CA--C 1.564 1.489 0 CA-C-O 122.244 1.021 . . . . 0.0 111.132 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.1 p-10 -64.82 42.71 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.341 0 N-CA-C 119.115 3.005 . . . . 0.0 119.115 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.8 p 67.17 84.22 0.16 Allowed 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 126.049 1.74 . . . . 0.0 113.725 173.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.273 4.3 mp 72.49 -48.56 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 C-N-CA 125.292 1.437 . . . . 0.0 113.63 177.099 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.8 mt -51.68 -27.47 11.79 Favored 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 118.33 2.715 . . . . 0.0 118.33 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.251 28.4 p 76.73 -2.6 2.66 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 118.988 2.958 . . . . 0.0 118.988 174.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.5 mp -73.95 95.01 2.41 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 121.041 1.746 . . . . 0.0 106.735 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.6 m -96.55 158.55 15.38 Favored 'General case' 0 CA--C 1.567 1.616 0 CA-C-O 122.874 1.321 . . . . 0.0 113.961 -170.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -141.55 138.39 32.65 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.675 -1.265 . . . . 0.0 110.922 -178.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 67.3 m -63.22 143.48 57.76 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 118.448 -2.658 . . . . 0.0 113.721 176.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.95 171.86 13.49 Favored 'General case' 0 CA--C 1.564 1.509 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -173.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -108.02 149.26 28.63 Favored 'General case' 0 CA--C 1.569 1.68 0 CA-C-N 114.481 -1.236 . . . . 0.0 110.793 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -53.38 142.59 21.24 Favored 'General case' 0 CA--C 1.577 2.007 0 N-CA-C 116.372 1.99 . . . . 0.0 116.372 176.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.4 168.79 19.43 Favored 'General case' 0 CA--C 1.574 1.882 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -174.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 63.1 mtt-85 -116.44 162.86 16.91 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.011 -1.056 . . . . 0.0 112.183 -177.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -55.4 126.76 26.48 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -175.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.265 66.9 m-80 77.76 20.82 1.01 Allowed 'General case' 0 CA--C 1.584 2.254 0 C-N-CA 125.267 1.427 . . . . 0.0 114.464 -173.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.0 t -119.51 155.15 32.68 Favored 'General case' 0 CA--C 1.565 1.529 0 O-C-N 120.477 -1.389 . . . . 0.0 110.742 173.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -61.93 130.01 43.64 Favored 'General case' 0 CA--C 1.566 1.568 0 CA-C-O 123.21 1.481 . . . . 0.0 114.479 -176.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.478 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 23.4 t -133.48 145.29 50.07 Favored 'General case' 0 CA--C 1.568 1.669 0 CA-C-N 113.022 -1.899 . . . . 0.0 112.752 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.5 m -120.57 137.65 54.29 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 105.245 -2.131 . . . . 0.0 105.245 171.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -82.07 -132.32 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.144 0 O-C-N 120.512 -1.368 . . . . 0.0 113.464 -174.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -133.15 156.25 47.8 Favored 'General case' 0 N--CA 1.491 1.584 1 N-CA-C 125.108 5.225 . . . . 0.0 125.108 -169.086 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.351 70.3 p 63.94 128.0 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.133 1 CA-C-N 108.115 -4.129 . . . . 0.0 115.165 -178.058 . . . . . . . . 3 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.346 0.4 OUTLIER -142.85 -81.08 0.2 Allowed 'General case' 0 CA--C 1.582 2.194 1 CA-C-N 108.228 -4.078 . . . . 0.0 100.683 -173.883 . . . . . . . . 4 3 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -159.22 -16.29 0.06 Allowed 'General case' 0 CA--C 1.611 3.312 0 C-N-CA 130.194 3.398 . . . . 0.0 107.907 169.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 118.0 58.48 0.28 Allowed Glycine 0 CA--C 1.562 2.982 0 C-N-CA 125.373 1.463 . . . . 0.0 113.773 -170.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.9 t -145.15 141.45 22.81 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.756 0 CA-C-N 121.791 2.796 . . . . 0.0 106.088 139.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -125.8 131.29 52.49 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 120.782 -1.198 . . . . 0.0 113.686 -172.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -69.1 -29.66 67.79 Favored 'General case' 0 CA--C 1.579 2.059 0 N-CA-C 116.133 1.901 . . . . 0.0 116.133 179.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -149.56 125.32 10.46 Favored 'General case' 0 CA--C 1.57 1.736 0 N-CA-C 105.823 -1.918 . . . . 0.0 105.823 174.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.2 m -55.23 152.19 16.15 Favored Pre-proline 0 CA--C 1.596 2.746 0 N-CA-C 116.797 2.147 . . . . 0.0 116.797 -175.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -78.45 37.48 0.64 Allowed 'Trans proline' 0 CA--C 1.569 2.271 1 N-CA-C 122.786 4.11 . . . . 0.0 122.786 -171.188 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.478 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 29.8 m 64.42 144.17 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 -178.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -66.24 145.94 55.19 Favored 'General case' 0 CA--C 1.569 1.677 0 O-C-N 119.816 -1.802 . . . . 0.0 112.961 176.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -62.97 119.76 10.06 Favored 'General case' 0 CA--C 1.565 1.538 0 CA-C-O 123.737 1.732 . . . . 0.0 114.628 -172.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 138.69 -48.76 0.86 Allowed Glycine 0 N--CA 1.49 2.299 0 CA-C-N 112.461 -2.154 . . . . 0.0 113.804 -172.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -105.08 173.69 6.2 Favored 'General case' 0 CA--C 1.575 1.915 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 175.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -100.64 155.1 18.07 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -173.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 37.3 t -96.36 127.8 42.69 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-N 113.324 -1.762 . . . . 0.0 110.895 172.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 . . . . . 0 N--CA 1.499 2.018 0 CA-C-N 120.728 1.604 . . . . 0.0 111.649 174.639 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 . . . . . 0 N--CA 1.495 1.819 0 CA-C-O 122.039 0.923 . . . . 0.0 112.213 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -86.76 -164.32 39.76 Favored Glycine 0 N--CA 1.487 2.046 0 O-C-N 121.071 -1.018 . . . . 0.0 115.457 175.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 33.9 mm -125.89 152.71 33.26 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.058 0 CA-C-O 122.882 1.325 . . . . 0.0 110.29 -174.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 58.6 m -76.11 122.09 23.77 Favored 'General case' 0 CA--C 1.57 1.722 0 O-C-N 120.312 -1.493 . . . . 0.0 112.379 172.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -138.51 143.01 39.34 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 123.414 1.578 . . . . 0.0 111.092 178.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 -98.93 137.14 37.91 Favored 'General case' 0 CA--C 1.56 1.355 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.578 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 57.9 t . . . . . 0 N--CA 1.496 1.872 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.45 -174.029 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 . . . . . 0 N--CA 1.502 2.131 0 CA-C-O 121.827 0.823 . . . . 0.0 112.642 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -138.41 157.39 46.31 Favored 'General case' 0 CA--C 1.573 1.849 0 CA-C-O 122.664 1.221 . . . . 0.0 111.941 172.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -78.11 167.19 21.82 Favored 'General case' 0 CA--C 1.569 1.693 0 O-C-N 120.337 -1.477 . . . . 0.0 113.961 -175.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -74.82 148.32 40.38 Favored 'General case' 0 CA--C 1.578 2.02 0 CA-C-O 122.312 1.053 . . . . 0.0 110.762 174.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.52 28.2 10.74 Favored Glycine 0 CA--C 1.56 2.888 0 N-CA-C 114.979 0.752 . . . . 0.0 114.979 -171.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -139.39 146.22 39.91 Favored 'General case' 0 CA--C 1.568 1.636 0 C-N-CA 125.157 1.383 . . . . 0.0 109.698 -175.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.2 tt -69.68 119.18 13.52 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 120.657 -1.277 . . . . 0.0 111.721 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 14.6 p -120.92 158.42 27.72 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -175.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -88.64 -84.79 0.2 Allowed 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 174.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.7 p30 -94.03 169.78 10.02 Favored 'General case' 0 N--CA 1.499 2.004 0 C-N-CA 124.021 0.928 . . . . 0.0 113.11 173.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.7 m -72.03 -23.08 61.33 Favored 'General case' 0 N--CA 1.504 2.261 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 174.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.28 12.06 1.04 Allowed 'General case' 0 CA--C 1.583 2.245 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 173.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 31.3 mm100 -93.1 -47.56 6.91 Favored 'General case' 0 CA--C 1.569 1.702 0 C-N-CA 125.05 1.34 . . . . 0.0 112.737 174.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 70.9 m -72.55 154.28 40.88 Favored 'General case' 0 CA--C 1.57 1.75 0 CA-C-N 120.451 1.478 . . . . 0.0 113.705 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -54.44 -57.39 11.5 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.944 -1.097 . . . . 0.0 111.1 174.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.1 m -83.75 106.31 15.35 Favored 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 103.606 -2.739 . . . . 0.0 103.606 168.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -68.89 85.0 0.32 Allowed 'General case' 0 N--CA 1.495 1.804 0 CA-C-O 124.185 1.945 . . . . 0.0 113.718 -173.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.7 t -151.66 73.12 1.06 Allowed 'General case' 0 CA--C 1.564 1.497 0 CA-C-N 113.01 -1.904 . . . . 0.0 111.165 -174.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 35.9 t -79.49 113.69 17.83 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 104.482 -2.414 . . . . 0.0 104.482 171.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -100.1 112.8 25.11 Favored 'General case' 0 CA--C 1.567 1.626 0 CA-C-O 123.179 1.466 . . . . 0.0 114.656 -170.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -82.46 144.66 30.3 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 126.118 1.767 . . . . 0.0 110.9 176.023 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -82.9 75.55 9.79 Favored 'General case' 0 CA--C 1.58 2.118 0 O-C-N 120.452 -1.405 . . . . 0.0 108.186 171.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.406 11.8 t 55.04 -106.63 0.34 Allowed 'General case' 0 N--CA 1.5 2.034 0 C-N-CA 126.275 1.83 . . . . 0.0 113.207 -173.293 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -103.22 -18.11 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.291 0 CA-C-N 120.68 1.582 . . . . 0.0 114.042 174.256 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.1 tp -72.74 121.74 20.35 Favored 'General case' 0 CA--C 1.569 1.707 0 CA-C-N 121.24 1.836 . . . . 0.0 108.838 173.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 82.1 p -83.86 100.49 11.01 Favored 'General case' 0 CA--C 1.568 1.654 0 N-CA-C 118.823 2.897 . . . . 0.0 118.823 -171.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 38.9 tp -149.23 87.29 1.52 Allowed 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 102.63 -3.1 . . . . 0.0 102.63 171.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 m -100.3 122.16 42.64 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 -171.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -133.49 137.27 45.57 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 124.679 1.192 . . . . 0.0 109.163 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 63.4 m -66.04 142.65 57.74 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 119.501 -1.999 . . . . 0.0 113.28 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -137.69 -172.95 3.36 Favored 'General case' 0 CA--C 1.569 1.691 0 CA-C-N 113.433 -1.712 . . . . 0.0 112.754 -174.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 37.8 tp -90.9 150.8 21.37 Favored 'General case' 0 CA--C 1.573 1.836 0 CA-C-O 122.264 1.031 . . . . 0.0 112.457 176.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -70.38 155.31 40.86 Favored 'General case' 0 CA--C 1.574 1.866 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 173.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.46 150.63 36.67 Favored 'General case' 0 CA--C 1.571 1.762 0 CA-C-O 124.561 2.124 . . . . 0.0 114.043 -174.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -124.61 168.17 13.5 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.186 -1.824 . . . . 0.0 110.857 -175.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -54.41 133.98 45.61 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.907 -1.121 . . . . 0.0 112.616 -176.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.391 8.8 p30 67.77 17.41 9.77 Favored 'General case' 0 CA--C 1.585 2.326 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -171.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.1 t -118.14 153.3 34.03 Favored 'General case' 0 CA--C 1.567 1.607 0 O-C-N 120.78 -1.2 . . . . 0.0 110.253 173.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -60.01 122.67 14.9 Favored 'General case' 0 CA--C 1.572 1.802 0 N-CA-C 117.448 2.388 . . . . 0.0 117.448 -174.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.2 t -142.81 132.52 23.93 Favored 'General case' 0 CA--C 1.56 1.352 0 CA-C-N 113.816 -1.538 . . . . 0.0 110.848 173.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 27.9 t -139.69 158.74 43.6 Favored 'General case' 0 CA--C 1.568 1.666 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 172.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -119.13 126.36 51.42 Favored 'General case' 0 CA--C 1.571 1.751 0 CA-C-O 124.599 2.142 . . . . 0.0 112.169 -173.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 19.8 p90 -146.47 -142.16 0.12 Allowed 'General case' 0 CA--C 1.579 2.095 0 CA-C-N 111.942 -2.39 . . . . 0.0 108.324 -172.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.0 m -63.95 111.33 2.45 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 119.537 -1.977 . . . . 0.0 109.336 171.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.458 2.3 mt -112.1 42.16 1.82 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 117.83 2.53 . . . . 0.0 117.83 -178.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . 0.362 0.5 OUTLIER -153.7 29.87 0.47 Allowed 'General case' 0 CA--C 1.583 2.246 0 CA-C-N 113.353 -1.749 . . . . 0.0 112.141 166.541 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -123.18 -131.86 3.88 Favored Glycine 0 CA--C 1.548 2.155 0 N-CA-C 108.722 -1.751 . . . . 0.0 108.722 172.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 14.2 t -101.84 144.09 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.503 0 O-C-N 121.169 -1.195 . . . . 0.0 108.795 170.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 15.3 m-30 -114.21 136.9 52.44 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 -169.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.36 -48.6 55.59 Favored 'General case' 0 CA--C 1.578 2.048 0 O-C-N 120.886 -1.134 . . . . 0.0 112.723 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.12 113.6 10.14 Favored 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 102.155 -3.276 . . . . 0.0 102.155 172.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 60.8 m -54.4 148.55 23.74 Favored Pre-proline 0 CA--C 1.587 2.387 0 N-CA-C 115.008 1.485 . . . . 0.0 115.008 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -64.74 169.06 12.12 Favored 'Trans proline' 0 CA--C 1.568 2.206 0 C-N-CA 122.384 2.056 . . . . 0.0 116.602 -173.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 83.8 m -67.72 154.03 42.41 Favored 'General case' 0 CA--C 1.572 1.824 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 -178.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.86 173.99 2.07 Favored 'General case' 0 CA--C 1.579 2.081 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -62.65 108.1 1.09 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.551 -1.343 . . . . 0.0 112.363 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 112.1 -22.51 18.21 Favored Glycine 0 N--CA 1.497 2.743 0 N-CA-C 117.749 1.859 . . . . 0.0 117.749 -173.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.9 mp -98.9 152.21 20.01 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-N 119.064 1.432 . . . . 0.0 112.531 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.3 159.49 15.21 Favored 'General case' 0 CA--C 1.564 1.487 0 CA-C-O 122.508 1.147 . . . . 0.0 112.556 177.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 4.9 t -89.44 96.54 10.75 Favored 'General case' 0 CA--C 1.573 1.845 0 N-CA-C 105.95 -1.87 . . . . 0.0 105.95 172.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 . . . . . 0 N--CA 1.495 1.812 0 O-C-N 120.69 -1.256 . . . . 0.0 114.374 -171.103 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.7 m-30 . . . . . 0 N--CA 1.499 2.006 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -94.25 -162.75 35.54 Favored Glycine 0 N--CA 1.488 2.15 0 CA-C-N 115.083 -0.962 . . . . 0.0 113.752 173.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.1 mm -135.53 142.74 38.65 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.009 0 O-C-N 121.761 -0.846 . . . . 0.0 110.537 -176.319 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 19.3 m -70.79 130.31 41.36 Favored 'General case' 0 CA--C 1.569 1.709 0 O-C-N 120.169 -1.582 . . . . 0.0 113.375 173.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -143.33 155.07 44.35 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 123.228 1.49 . . . . 0.0 112.439 175.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -97.95 73.99 2.29 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 122.794 1.283 . . . . 0.0 111.617 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.501 2.124 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -179.492 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 . . . . . 0 N--CA 1.495 1.784 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.4 tp -150.23 115.33 5.38 Favored 'General case' 0 CA--C 1.577 1.998 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 173.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -75.55 162.31 28.4 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 115.845 1.795 . . . . 0.0 115.845 -172.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.91 140.86 56.38 Favored 'General case' 0 CA--C 1.574 1.869 0 CA-C-O 122.481 1.134 . . . . 0.0 113.809 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.91 2.35 61.12 Favored Glycine 0 N--CA 1.496 2.659 0 N-CA-C 117.856 1.902 . . . . 0.0 117.856 -174.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -112.42 133.04 54.72 Favored 'General case' 0 CA--C 1.566 1.565 0 CA-C-N 118.935 1.367 . . . . 0.0 110.082 -175.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.9 tt -68.33 119.86 13.52 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.424 -0.797 . . . . 0.0 111.834 -176.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 24.7 p -128.07 158.42 38.01 Favored 'General case' 0 CA--C 1.558 1.268 0 CA-C-O 122.35 1.072 . . . . 0.0 112.798 -175.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.8 mt -92.98 -73.67 0.55 Allowed 'General case' 0 CA--C 1.568 1.664 0 O-C-N 120.835 -1.166 . . . . 0.0 108.61 173.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -91.94 150.75 20.85 Favored 'General case' 0 CA--C 1.569 1.674 0 N-CA-C 115.822 1.786 . . . . 0.0 115.822 178.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.1 m -68.56 -16.51 63.89 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 124.93 1.292 . . . . 0.0 114.162 170.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . 0.325 . . -75.03 28.64 0.09 Allowed 'General case' 0 CA--C 1.594 2.645 0 C-N-CA 126.608 1.963 . . . . 0.0 114.036 171.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -138.52 -39.52 0.52 Allowed 'General case' 0 CA--C 1.583 2.217 0 C-N-CA 127.731 2.413 . . . . 0.0 113.126 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.9 m -65.18 -171.67 0.08 Allowed 'General case' 0 CA--C 1.587 2.388 0 CA-C-N 121.817 2.099 . . . . 0.0 115.201 -177.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -70.12 -57.63 4.73 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 119.101 -2.249 . . . . 0.0 115.225 -175.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 36.3 m -82.37 -78.87 0.19 Allowed 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 173.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -174.49 68.95 0.03 OUTLIER 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 173.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.3 t -151.87 94.24 1.95 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 118.885 -2.385 . . . . 0.0 116.553 -174.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 26.3 t -95.63 112.61 24.29 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 101.283 -3.599 . . . . 0.0 101.283 168.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -91.7 124.06 35.56 Favored 'General case' 0 CA--C 1.562 1.421 0 CA-C-O 122.548 1.166 . . . . 0.0 113.786 -171.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -79.27 131.96 36.32 Favored 'General case' 0 CA--C 1.56 1.361 0 C-N-CA 125.098 1.359 . . . . 0.0 112.031 -174.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.83 31.29 0.09 Allowed 'General case' 0 CA--C 1.585 2.293 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.253 24.9 p 70.31 100.69 0.06 Allowed 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 126.47 1.908 . . . . 0.0 112.096 179.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.29 3.7 mp 72.83 -63.66 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 C-N-CA 125.477 1.511 . . . . 0.0 111.614 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.7 tp -68.26 128.89 38.21 Favored 'General case' 0 CA--C 1.571 1.755 0 CA-C-N 120.624 1.556 . . . . 0.0 110.776 174.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.9 p -86.65 31.5 0.68 Allowed 'General case' 0 CA--C 1.571 1.782 0 N-CA-C 118.954 2.946 . . . . 0.0 118.954 -173.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 31.3 tp -82.42 93.61 7.25 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 172.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.1 m -97.35 148.93 22.66 Favored 'General case' 0 CA--C 1.566 1.56 0 CA-C-O 123.325 1.536 . . . . 0.0 114.022 -170.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 57.2 ttm-85 -141.2 137.2 32.47 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.197 -0.939 . . . . 0.0 109.676 -176.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 58.7 m -61.07 140.09 57.94 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 119.632 -1.917 . . . . 0.0 111.896 175.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.69 178.12 7.46 Favored 'General case' 0 CA--C 1.565 1.548 0 N-CA-C 116.492 2.034 . . . . 0.0 116.492 -172.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.8 tp -86.77 149.6 24.75 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-O 122.26 1.029 . . . . 0.0 112.248 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -67.12 141.1 57.54 Favored 'General case' 0 CA--C 1.572 1.793 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 174.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.73 162.12 28.48 Favored 'General case' 0 CA--C 1.571 1.774 0 CA-C-O 124.181 1.943 . . . . 0.0 115.173 -176.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -111.09 -178.81 3.56 Favored 'General case' 0 CA--C 1.567 1.61 0 CA-C-N 113.397 -1.729 . . . . 0.0 113.082 -173.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -60.0 135.34 57.68 Favored 'General case' 0 CA--C 1.568 1.648 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -176.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 66.72 38.14 4.0 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 124.902 1.281 . . . . 0.0 113.307 -173.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 10.9 t -128.19 140.36 51.95 Favored 'General case' 0 CA--C 1.561 1.391 0 O-C-N 121.011 -1.055 . . . . 0.0 111.991 178.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -73.06 97.05 2.27 Favored 'General case' 0 CA--C 1.572 1.793 0 C-N-CA 124.13 0.972 . . . . 0.0 112.226 178.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.16 136.48 36.57 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-O 122.117 0.961 . . . . 0.0 112.057 177.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 91.8 p -88.06 116.12 26.02 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 105.226 -2.139 . . . . 0.0 105.226 171.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -80.02 -117.9 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.964 0 CA-C-O 116.219 -1.848 . . . . 0.0 114.583 -172.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -130.42 154.0 48.18 Favored 'General case' 0 CA--C 1.567 1.6 1 N-CA-C 123.486 4.625 . . . . 0.0 123.486 -170.165 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.434 24.0 p 43.29 122.15 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.258 0 CA-C-N 108.4 -4.0 . . . . 0.0 116.378 -172.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.418 0.0 OUTLIER -145.54 -71.55 0.26 Allowed 'General case' 0 CA--C 1.576 1.946 1 CA-C-N 107.695 -4.32 . . . . 0.0 102.142 -173.309 . . . . . . . . 4 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -158.99 -30.77 0.07 Allowed 'General case' 0 CA--C 1.591 2.55 0 C-N-CA 127.694 2.398 . . . . 0.0 110.474 171.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 122.93 43.82 0.35 Allowed Glycine 0 CA--C 1.556 2.605 0 N-CA-C 117.436 1.735 . . . . 0.0 117.436 -172.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 11.3 t -138.84 132.68 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.422 0 CA-C-N 122.958 3.379 . . . . 0.0 106.428 145.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -117.84 132.11 56.48 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.744 -172.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -61.97 -42.62 99.33 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 120.038 -1.663 . . . . 0.0 115.402 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -142.76 119.27 11.0 Favored 'General case' 0 CA--C 1.562 1.408 0 N-CA-C 105.277 -2.12 . . . . 0.0 105.277 174.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 84.2 m -44.17 148.95 0.75 Allowed Pre-proline 0 CA--C 1.593 2.607 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 -176.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -70.05 42.23 0.36 Allowed 'Trans proline' 0 CA--C 1.574 2.519 1 N-CA-C 122.521 4.008 . . . . 0.0 122.521 -171.256 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 67.6 m 58.98 154.13 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 117.516 2.413 . . . . 0.0 117.516 175.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -62.27 151.83 35.31 Favored 'General case' 0 CA--C 1.573 1.837 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -179.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -68.98 104.08 2.0 Favored 'General case' 0 CA--C 1.573 1.84 0 CA-C-O 122.38 1.086 . . . . 0.0 112.324 -174.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 136.44 -29.49 2.79 Favored Glycine 0 N--CA 1.497 2.742 0 N-CA-C 116.108 1.203 . . . . 0.0 116.108 -173.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.5 mp -96.88 144.6 26.67 Favored 'General case' 0 CA--C 1.566 1.567 0 C-N-CA 124.372 1.069 . . . . 0.0 111.538 177.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -99.43 135.77 40.36 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 122.012 0.911 . . . . 0.0 111.567 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 30.3 t -94.99 113.89 25.64 Favored 'General case' 0 CA--C 1.568 1.641 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.669 175.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 N--CA 1.501 2.095 0 O-C-N 120.122 -1.611 . . . . 0.0 113.319 -174.317 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 . . . . . 0 N--CA 1.5 2.026 0 CA-C-O 122.726 1.25 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -73.6 135.61 20.9 Favored Glycine 0 N--CA 1.487 2.048 0 N-CA-C 116.645 1.418 . . . . 0.0 116.645 -179.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.6 mm -89.76 134.15 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 CA-C-O 122.743 1.259 . . . . 0.0 109.047 -174.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 69.6 m -80.81 122.42 27.16 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -132.79 153.02 51.65 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 122.733 1.254 . . . . 0.0 110.701 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -93.61 127.14 39.14 Favored 'General case' 0 CA--C 1.56 1.36 0 CA-C-O 122.834 1.302 . . . . 0.0 110.617 -174.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.4 p . . . . . 0 N--CA 1.494 1.763 0 CA-C-N 114.124 -1.398 . . . . 0.0 113.422 -173.684 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.253 69.3 m-80 . . . . . 0 N--CA 1.505 2.312 0 CA-C-O 122.441 1.115 . . . . 0.0 111.308 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -141.75 164.3 30.56 Favored 'General case' 0 CA--C 1.577 2.011 0 CA-C-O 122.519 1.152 . . . . 0.0 111.491 173.746 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -80.14 167.34 20.48 Favored 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 116.291 1.96 . . . . 0.0 116.291 -173.231 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -72.03 138.91 48.25 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.433 0.693 . . . . 0.0 110.418 175.005 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 92.83 5.84 64.14 Favored Glycine 0 CA--C 1.558 2.766 0 N-CA-C 116.23 1.252 . . . . 0.0 116.23 -172.149 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -109.09 144.38 37.2 Favored 'General case' 0 CA--C 1.567 1.611 0 CA-C-N 119.002 1.401 . . . . 0.0 109.925 174.475 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 tt -67.4 115.45 7.06 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -174.744 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.5 p -110.91 152.82 26.3 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 124.359 1.063 . . . . 0.0 113.264 179.411 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.3 mt -84.54 -78.69 0.24 Allowed 'General case' 0 CA--C 1.568 1.657 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 174.127 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -96.09 177.85 5.6 Favored 'General case' 0 CA--C 1.578 2.052 0 O-C-N 121.202 -0.936 . . . . 0.0 113.191 172.795 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.1 m -77.37 -19.37 56.32 Favored 'General case' 0 N--CA 1.504 2.25 0 N-CA-C 116.48 2.03 . . . . 0.0 116.48 174.894 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.32 17.71 0.47 Allowed 'General case' 0 CA--C 1.581 2.164 0 N-CA-C 116.655 2.095 . . . . 0.0 116.655 173.939 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -96.9 -48.87 5.26 Favored 'General case' 0 CA--C 1.57 1.723 0 C-N-CA 125.127 1.371 . . . . 0.0 114.1 -177.194 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 87.9 m -81.19 170.63 15.89 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 115.965 1.839 . . . . 0.0 115.965 -177.4 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -63.06 -55.83 22.15 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 123.561 0.745 . . . . 0.0 109.283 171.531 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.4 t -82.56 100.4 10.1 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 104.166 -2.531 . . . . 0.0 104.166 169.077 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -72.67 71.86 1.01 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 125.081 2.372 . . . . 0.0 114.39 -173.642 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 t -148.02 86.19 1.56 Allowed 'General case' 0 CA--C 1.559 1.316 0 CA-C-N 112.373 -2.194 . . . . 0.0 109.513 -173.531 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.7 t -80.66 119.5 23.37 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 120.586 -1.321 . . . . 0.0 107.908 173.857 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.9 tp60 -101.42 117.51 35.08 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.542 1.137 . . . . 0.0 113.22 -172.96 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 8.4 m170 -60.73 159.59 10.69 Favored 'General case' 0 CA--C 1.567 1.603 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 177.162 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -89.91 60.37 4.92 Favored 'General case' 0 CA--C 1.578 2.04 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 171.126 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.7 m 80.96 -75.3 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.191 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 -169.06 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.0 mt -138.2 -115.25 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.584 2.253 0 N-CA-C 103.502 -2.777 . . . . 0.0 103.502 172.535 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.251 3.8 mm? 41.59 -107.89 0.09 Allowed 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 127.123 2.169 . . . . 0.0 114.806 174.56 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 89.8 p -152.1 -111.3 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.315 0 CA-C-O 116.133 -1.889 . . . . 0.0 109.709 173.27 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.0 tp 23.24 60.97 0.04 OUTLIER 'General case' 0 N--CA 1.514 2.761 0 CA-C-N 121.362 1.892 . . . . 0.0 115.683 -174.35 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 45.2 m -99.17 119.15 37.39 Favored 'General case' 0 CA--C 1.554 1.098 0 CA-C-N 114.257 -1.338 . . . . 0.0 112.298 -170.664 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -99.11 165.65 11.62 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.961 -0.462 . . . . 0.0 110.469 175.083 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 45.9 m -80.59 152.16 28.71 Favored 'General case' 0 CA--C 1.563 1.475 0 O-C-N 119.064 -2.272 . . . . 0.0 112.12 173.447 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.66 -178.76 5.67 Favored 'General case' 0 CA--C 1.569 1.675 0 CA-C-N 113.282 -1.781 . . . . 0.0 112.689 -173.915 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -88.42 137.32 32.43 Favored 'General case' 0 CA--C 1.568 1.642 0 O-C-N 121.01 -1.056 . . . . 0.0 112.571 179.629 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.97 155.42 30.8 Favored 'General case' 0 CA--C 1.576 1.979 0 CA-C-O 121.868 0.842 . . . . 0.0 110.709 172.422 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.53 156.43 27.77 Favored 'General case' 0 CA--C 1.568 1.642 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 -173.634 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 22.7 mtm180 -129.29 172.93 10.99 Favored 'General case' 0 CA--C 1.563 1.47 0 CA-C-N 112.806 -1.997 . . . . 0.0 109.761 177.558 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -48.77 130.45 17.73 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 115.62 1.711 . . . . 0.0 115.62 -173.891 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.8 m120 77.19 10.24 2.52 Favored 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 -174.182 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 30.7 t -109.26 148.75 30.48 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 120.532 1.514 . . . . 0.0 112.268 175.277 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -79.76 112.56 17.16 Favored 'General case' 0 CA--C 1.57 1.744 0 CA-C-O 123.839 1.781 . . . . 0.0 112.747 -178.346 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.97 177.4 5.44 Favored 'General case' 0 CA--C 1.571 1.772 0 CA-C-N 112.304 -2.225 . . . . 0.0 111.048 173.639 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.432 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 58.3 m -79.65 -113.03 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 104.872 -2.27 . . . . 0.0 104.872 170.017 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -160.17 -80.53 0.05 OUTLIER 'General case' 0 CA--C 1.564 1.486 0 CA-C-N 122.862 2.573 . . . . 0.0 110.788 172.272 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -77.63 -46.34 22.36 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 174.743 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.9 p 60.74 153.62 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 124.954 2.312 . . . . 0.0 116.447 -176.858 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -97.59 179.45 4.84 Favored 'General case' 0 CA--C 1.583 2.234 0 CA-C-N 112.71 -2.041 . . . . 0.0 108.685 171.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -84.76 12.84 6.54 Favored 'General case' 0 N--CA 1.514 2.743 0 O-C-N 118.422 -2.674 . . . . 0.0 114.036 174.009 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -113.41 -152.42 11.0 Favored Glycine 0 N--CA 1.476 1.357 0 O-C-N 120.99 -1.069 . . . . 0.0 114.226 -173.831 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.5 t -78.49 142.08 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 CA-C-O 122.912 1.339 . . . . 0.0 111.314 -167.442 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -119.51 153.61 35.09 Favored 'General case' 0 CA--C 1.561 1.393 0 N-CA-C 116.468 2.025 . . . . 0.0 116.468 -171.329 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -83.03 -56.08 4.0 Favored 'General case' 0 CA--C 1.577 2.016 0 CA-C-N 113.253 -1.794 . . . . 0.0 110.077 172.964 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -133.16 108.01 8.54 Favored 'General case' 0 CA--C 1.564 1.505 0 N-CA-C 104.606 -2.368 . . . . 0.0 104.606 173.448 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.6 m -52.11 153.06 5.08 Favored Pre-proline 0 CA--C 1.584 2.259 0 N-CA-C 118.433 2.753 . . . . 0.0 118.433 -175.333 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -70.31 172.29 13.45 Favored 'Trans proline' 0 CA--C 1.568 2.204 0 C-N-CA 122.687 2.258 . . . . 0.0 115.574 -177.904 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 60.4 m -70.77 156.39 39.58 Favored 'General case' 0 CA--C 1.571 1.754 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 177.312 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.53 168.55 3.56 Favored 'General case' 0 CA--C 1.58 2.099 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 174.793 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 91.5 mtt180 -63.03 112.16 2.48 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.227 -1.546 . . . . 0.0 113.492 -175.52 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 114.42 -22.83 13.0 Favored Glycine 0 N--CA 1.495 2.622 0 N-CA-C 118.926 2.33 . . . . 0.0 118.926 -173.984 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.7 mp -99.43 143.76 29.31 Favored 'General case' 0 CA--C 1.572 1.792 0 CA-C-N 119.462 1.631 . . . . 0.0 112.877 -176.02 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -102.23 155.44 18.22 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 124.116 0.967 . . . . 0.0 113.413 -177.308 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.432 ' SG ' ' O ' ' A' ' 50' ' ' SER . 1.9 t -94.67 83.71 4.12 Favored 'General case' 0 CA--C 1.579 2.079 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 179.684 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 . . . . . 0 N--CA 1.497 1.893 0 O-C-N 120.476 -1.39 . . . . 0.0 112.034 -176.703 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.9 m-30 . . . . . 0 N--CA 1.497 1.9 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -160.55 167.31 35.69 Favored Glycine 0 CA--C 1.556 2.61 0 C-N-CA 124.895 1.236 . . . . 0.0 112.866 -179.573 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.5 mm -98.35 134.14 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.519 0 O-C-N 119.582 -2.128 . . . . 0.0 110.436 -179.388 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 94.9 m -63.21 123.83 19.64 Favored 'General case' 0 CA--C 1.572 1.792 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 174.662 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 79.0 m-70 -144.33 155.48 43.83 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-O 122.553 1.168 . . . . 0.0 111.613 175.57 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 40.0 t-20 -96.71 122.92 40.18 Favored 'General case' 0 CA--C 1.566 1.594 0 O-C-N 120.892 -1.13 . . . . 0.0 110.354 179.433 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 N--CA 1.498 1.96 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 -174.964 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.307 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.205 0 N-CA-C 116.656 2.095 . . . . 0.0 116.656 . . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 tp -132.34 120.49 22.14 Favored 'General case' 0 CA--C 1.569 1.707 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 -174.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -81.78 173.55 12.18 Favored 'General case' 0 CA--C 1.569 1.693 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 -172.659 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -56.37 137.87 51.94 Favored 'General case' 0 CA--C 1.568 1.652 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 176.787 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.8 -17.49 27.6 Favored Glycine 0 N--CA 1.497 2.734 0 N-CA-C 118.122 2.009 . . . . 0.0 118.122 -177.162 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -100.3 145.56 27.99 Favored 'General case' 0 CA--C 1.564 1.503 0 CA-C-N 118.428 1.114 . . . . 0.0 112.216 -177.251 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 72.6 mt -77.9 137.55 38.42 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 122.08 0.943 . . . . 0.0 113.119 -179.634 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.6 p -138.62 149.65 45.44 Favored 'General case' 0 CA--C 1.562 1.417 0 CA-C-O 122.073 0.939 . . . . 0.0 112.827 -174.567 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 98.7 mt -84.38 -74.04 0.4 Allowed 'General case' 0 CA--C 1.567 1.616 0 O-C-N 121.424 -0.797 . . . . 0.0 109.126 174.434 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.8 p30 -95.06 173.58 7.51 Favored 'General case' 0 CA--C 1.577 1.984 0 CA-C-N 120.111 1.323 . . . . 0.0 113.473 172.846 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.8 m -78.69 -19.27 52.86 Favored 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 116.994 2.22 . . . . 0.0 116.994 174.923 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.72 31.62 0.16 Allowed 'General case' 0 CA--C 1.579 2.083 0 N-CA-C 116.685 2.105 . . . . 0.0 116.685 174.342 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -114.72 -34.77 5.05 Favored 'General case' 0 CA--C 1.576 1.977 0 C-N-CA 126.414 1.886 . . . . 0.0 113.003 174.393 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . 0.273 67.3 m -80.67 -133.82 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.909 0 CA-C-N 120.87 1.668 . . . . 0.0 114.533 -174.983 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.3 -77.43 0.19 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 119.238 -2.164 . . . . 0.0 112.378 -173.777 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 77.4 p -88.33 -63.86 1.23 Allowed 'General case' 0 CA--C 1.568 1.653 0 CA-C-O 122.547 1.165 . . . . 0.0 110.481 173.09 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -169.66 81.78 0.12 Allowed 'General case' 0 CA--C 1.568 1.665 0 N-CA-C 103.991 -2.596 . . . . 0.0 103.991 177.416 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 53.5 t -140.85 62.98 1.47 Allowed 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 118.634 2.827 . . . . 0.0 118.634 -171.71 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 22.7 t -93.39 116.68 29.23 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 170.796 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.31 118.42 36.85 Favored 'General case' 0 CA--C 1.57 1.718 0 CA-C-O 122.663 1.221 . . . . 0.0 113.716 -172.367 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -84.13 125.09 31.83 Favored 'General case' 0 CA--C 1.564 1.491 0 C-N-CA 124.921 1.289 . . . . 0.0 111.184 -178.025 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . 0.3 0.3 OUTLIER -83.41 57.64 4.12 Favored 'General case' 0 CA--C 1.58 2.117 0 O-C-N 120.735 -1.228 . . . . 0.0 114.252 175.191 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.351 18.3 p 90.83 178.77 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.756 0 C-N-CA 127.13 2.172 . . . . 0.0 112.354 -174.897 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 14.8 mm -59.86 -62.45 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 119.616 -1.928 . . . . 0.0 115.282 -172.695 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.5 tp -92.62 79.93 4.82 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-N 120.184 1.356 . . . . 0.0 108.863 174.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.3 p -145.96 172.23 13.67 Favored 'General case' 0 CA--C 1.568 1.67 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 -173.194 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 39.9 tp -88.16 140.08 29.85 Favored 'General case' 0 CA--C 1.574 1.865 0 CA-C-O 121.682 0.753 . . . . 0.0 111.507 174.514 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.5 m -104.61 110.92 23.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.951 -1.093 . . . . 0.0 112.063 -175.024 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.5 ttp180 -121.12 142.02 50.26 Favored 'General case' 0 CA--C 1.567 1.629 0 C-N-CA 124.21 1.004 . . . . 0.0 109.758 178.615 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 55.2 m -69.81 150.78 46.49 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-O 124.776 2.227 . . . . 0.0 114.323 179.03 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -132.39 -178.39 4.9 Favored 'General case' 0 CA--C 1.562 1.442 0 CA-C-N 111.774 -2.466 . . . . 0.0 113.111 -174.18 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.1 mt -84.89 138.19 32.68 Favored 'General case' 0 CA--C 1.567 1.597 0 O-C-N 121.242 -0.911 . . . . 0.0 111.742 177.75 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -68.4 139.64 55.8 Favored 'General case' 0 CA--C 1.576 1.945 0 O-C-N 121.56 -0.712 . . . . 0.0 111.065 173.841 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.39 151.31 39.72 Favored 'General case' 0 CA--C 1.57 1.712 0 N-CA-C 118.122 2.638 . . . . 0.0 118.122 -171.359 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 50.5 mtp180 -104.1 168.95 8.78 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 112.809 -1.996 . . . . 0.0 111.866 -178.903 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -52.77 126.68 20.81 Favored 'General case' 0 CA--C 1.573 1.837 0 N-CA-C 114.222 1.194 . . . . 0.0 114.222 -174.915 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 71.66 32.65 1.95 Allowed 'General case' 0 N--CA 1.503 2.214 0 C-N-CA 125.132 1.373 . . . . 0.0 113.599 -172.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.7 m -130.24 153.49 48.55 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.685 -1.26 . . . . 0.0 111.033 174.83 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -69.98 136.1 50.1 Favored 'General case' 0 CA--C 1.574 1.882 0 CA-C-O 124.002 1.858 . . . . 0.0 114.412 -176.177 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.7 p -138.93 148.25 43.32 Favored 'General case' 0 CA--C 1.566 1.593 0 CA-C-N 112.563 -2.108 . . . . 0.0 111.496 -178.372 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.3 m -78.25 107.76 11.09 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.277 -1.514 . . . . 0.0 108.253 174.299 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.34 -40.14 62.36 Favored 'General case' 0 CA--C 1.57 1.718 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -174.618 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -86.36 145.65 26.8 Favored 'General case' 0 CA--C 1.571 1.781 0 C-N-CA 124.344 1.058 . . . . 0.0 109.202 172.278 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.7 p -123.93 145.7 48.96 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-O 123.796 1.76 . . . . 0.0 109.867 173.406 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.264 0.6 OUTLIER -109.1 -135.25 0.35 Allowed 'General case' 0 CA--C 1.565 1.55 0 CA-C-N 113.404 -1.725 . . . . 0.0 106.668 174.551 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -130.95 71.34 1.47 Allowed 'General case' 0 CA--C 1.569 1.69 0 N-CA-C 104.023 -2.584 . . . . 0.0 104.023 170.178 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 169.74 -159.72 32.52 Favored Glycine 0 N--CA 1.486 1.968 0 N-CA-C 117.125 1.61 . . . . 0.0 117.125 -174.177 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.2 t -79.19 146.92 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.99 0 CA-C-O 122.343 1.068 . . . . 0.0 112.277 -166.801 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -123.87 158.41 31.95 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -173.153 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -86.16 -21.91 27.3 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 174.373 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -146.37 122.8 11.01 Favored 'General case' 0 CA--C 1.564 1.519 0 N-CA-C 105.507 -2.035 . . . . 0.0 105.507 177.826 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 56.9 m -58.91 134.05 87.07 Favored Pre-proline 0 CA--C 1.597 2.775 0 O-C-N 119.888 -1.758 . . . . 0.0 115.27 -179.907 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -66.76 64.77 0.56 Allowed 'Trans proline' 0 CA--C 1.581 2.825 0 N-CA-C 121.307 3.541 . . . . 0.0 121.307 -174.064 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 69.1 m 58.53 164.0 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 175.838 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -79.21 166.27 22.36 Favored 'General case' 0 CA--C 1.576 1.977 0 O-C-N 120.64 -1.287 . . . . 0.0 113.934 174.287 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -63.43 115.29 4.49 Favored 'General case' 0 CA--C 1.573 1.864 0 O-C-N 120.965 -1.085 . . . . 0.0 113.612 -178.05 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 107.31 -17.99 36.46 Favored Glycine 0 N--CA 1.5 2.931 0 N-CA-C 118.311 2.084 . . . . 0.0 118.311 -174.193 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.1 mp -98.04 151.81 19.94 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-N 118.584 1.192 . . . . 0.0 111.638 179.049 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -100.26 149.87 23.14 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.835 -1.166 . . . . 0.0 112.192 175.982 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 11.8 t -92.6 120.03 32.64 Favored 'General case' 0 CA--C 1.567 1.634 0 CA-C-N 115.07 -0.968 . . . . 0.0 108.892 172.924 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 . . . . . 0 N--CA 1.492 1.654 0 O-C-N 120.748 -1.22 . . . . 0.0 110.991 -174.031 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 122.426 1.107 . . . . 0.0 112.212 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.39 157.57 51.64 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 115.717 1.047 . . . . 0.0 115.717 177.314 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 33.3 mm -104.52 140.41 22.66 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 121.22 -1.165 . . . . 0.0 110.925 -172.224 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 89.6 m -72.22 122.92 21.87 Favored 'General case' 0 CA--C 1.566 1.561 0 O-C-N 120.567 -1.333 . . . . 0.0 113.465 174.637 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -133.55 151.36 51.72 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.825 -1.172 . . . . 0.0 110.393 176.296 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -94.36 127.3 40.16 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 122.517 1.151 . . . . 0.0 111.271 -174.374 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 N--CA 1.501 2.09 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 -173.97 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 . . . . . 0 N--CA 1.5 2.045 0 N-CA-C 117.495 2.406 . . . . 0.0 117.495 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . 0.25 28.3 tp -110.13 133.78 52.87 Favored 'General case' 0 CA--C 1.581 2.136 0 O-C-N 120.665 -1.272 . . . . 0.0 109.392 174.42 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -77.18 160.5 28.91 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 119.509 -1.995 . . . . 0.0 115.369 -173.934 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.38 128.25 34.98 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 122.215 1.007 . . . . 0.0 109.855 173.409 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 96.89 24.37 13.32 Favored Glycine 0 CA--C 1.557 2.663 0 N-CA-C 116.423 1.329 . . . . 0.0 116.423 -172.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -129.27 139.25 51.87 Favored 'General case' 0 CA--C 1.567 1.63 0 CA-C-N 118.533 1.167 . . . . 0.0 109.427 177.638 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.8 mp -65.7 128.74 37.18 Favored 'General case' 0 CA--C 1.574 1.891 0 O-C-N 120.919 -1.113 . . . . 0.0 112.746 -178.063 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.0 p -129.16 154.09 47.08 Favored 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 -174.313 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.4 mt -85.46 -76.82 0.31 Allowed 'General case' 0 CA--C 1.568 1.64 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 173.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.8 p30 -97.35 172.92 7.47 Favored 'General case' 0 CA--C 1.577 2.002 0 CA-C-N 120.003 1.274 . . . . 0.0 113.747 172.915 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.6 m -77.75 -20.63 53.1 Favored 'General case' 0 N--CA 1.505 2.28 0 N-CA-C 116.956 2.206 . . . . 0.0 116.956 175.001 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.58 10.74 1.56 Allowed 'General case' 0 CA--C 1.575 1.928 0 N-CA-C 117.292 2.33 . . . . 0.0 117.292 174.951 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -97.17 -29.28 13.68 Favored 'General case' 0 CA--C 1.576 1.964 0 C-N-CA 125.152 1.381 . . . . 0.0 114.224 173.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 5.3 m -80.78 159.31 25.19 Favored 'General case' 0 CA--C 1.574 1.87 0 N-CA-C 115.081 1.511 . . . . 0.0 115.081 -179.521 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.7 mptt -63.51 -57.31 10.59 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 120.843 -1.161 . . . . 0.0 108.906 170.717 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.8 t -82.02 104.19 12.2 Favored 'General case' 0 CA--C 1.565 1.548 0 N-CA-C 104.537 -2.394 . . . . 0.0 104.537 170.166 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -68.59 82.31 0.27 Allowed 'General case' 0 N--CA 1.5 2.056 0 CA-C-O 124.411 2.053 . . . . 0.0 113.445 -172.89 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 49.7 t -160.7 87.17 0.74 Allowed 'General case' 0 CA--C 1.558 1.272 0 CA-C-N 112.499 -2.137 . . . . 0.0 111.421 -177.284 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 37.1 t -79.16 110.7 14.67 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 102.911 -2.996 . . . . 0.0 102.911 170.557 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.69 112.82 24.9 Favored 'General case' 0 CA--C 1.557 1.218 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -170.384 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.6 t-80 -81.02 141.18 34.65 Favored 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 124.822 1.249 . . . . 0.0 113.126 -175.702 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.2 p-10 -69.45 17.32 0.05 OUTLIER 'General case' 0 CA--C 1.591 2.558 0 N-CA-C 117.753 2.501 . . . . 0.0 117.753 172.412 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.275 43.0 p 74.75 97.59 0.07 Allowed 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 127.216 2.206 . . . . 0.0 112.402 176.683 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.276 37.3 mm 75.12 -49.98 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.387 0 C-N-CA 125.464 1.506 . . . . 0.0 115.014 174.775 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.258 0.5 OUTLIER -76.9 -121.82 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.143 0 CA-C-N 122.551 2.432 . . . . 0.0 112.965 -179.223 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 82.9 p -159.72 102.09 1.5 Allowed 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 123.943 3.065 . . . . 0.0 117.167 179.964 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 tt -164.39 105.76 0.87 Allowed 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 102.802 -3.036 . . . . 0.0 102.802 173.307 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.6 m -121.13 122.7 40.58 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.865 0.84 . . . . 0.0 112.313 -173.666 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -138.22 136.38 36.52 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 123.94 0.896 . . . . 0.0 110.627 -174.312 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 67.1 m -61.5 146.26 49.18 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 119.906 -1.746 . . . . 0.0 114.839 -177.48 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -142.74 169.58 17.3 Favored 'General case' 0 CA--C 1.567 1.601 0 CA-C-O 123.663 1.697 . . . . 0.0 115.028 -174.514 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -91.07 167.9 12.03 Favored 'General case' 0 CA--C 1.573 1.835 0 CA-C-N 114.329 -1.305 . . . . 0.0 111.459 173.89 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.9 158.5 25.08 Favored 'General case' 0 CA--C 1.584 2.27 0 O-C-N 120.344 -1.472 . . . . 0.0 113.467 174.492 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.49 166.94 22.68 Favored 'General case' 0 CA--C 1.572 1.822 0 O-C-N 120.236 -1.54 . . . . 0.0 113.161 177.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -96.54 163.11 13.17 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.553 -1.342 . . . . 0.0 112.895 -174.408 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -63.89 129.08 38.62 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.337 0.589 . . . . 0.0 111.083 177.364 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 79.81 14.95 0.9 Allowed 'General case' 0 N--CA 1.509 2.477 0 C-N-CA 125.069 1.348 . . . . 0.0 113.758 -171.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 27.2 t -113.88 160.14 19.09 Favored 'General case' 0 CA--C 1.566 1.578 0 O-C-N 120.385 -1.447 . . . . 0.0 111.887 174.73 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 65.8 mt-10 -70.85 116.81 11.58 Favored 'General case' 0 CA--C 1.571 1.771 0 CA-C-O 122.925 1.345 . . . . 0.0 113.729 -175.69 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 15.5 p -124.04 160.5 27.55 Favored 'General case' 0 CA--C 1.568 1.644 0 CA-C-N 113.987 -1.461 . . . . 0.0 113.812 177.766 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.6 t -134.22 123.81 24.92 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 105.363 -2.088 . . . . 0.0 105.363 171.775 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.96 62.82 3.49 Favored 'General case' 0 CA--C 1.565 1.557 0 N-CA-C 115.915 1.821 . . . . 0.0 115.915 -173.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.13 141.62 25.38 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 118.742 2.867 . . . . 0.0 118.742 -172.485 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 64.8 p -141.74 147.87 38.09 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 123.396 1.57 . . . . 0.0 108.834 172.201 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -134.59 -124.25 0.16 Allowed 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 174.598 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -132.61 57.97 1.78 Allowed 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 173.476 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -169.93 -172.48 36.49 Favored Glycine 0 N--CA 1.487 2.037 0 N-CA-C 115.584 0.994 . . . . 0.0 115.584 -173.396 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.3 t -81.45 143.42 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 CA-C-O 122.233 1.016 . . . . 0.0 111.808 -172.569 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -119.33 139.89 51.22 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-O 121.909 0.862 . . . . 0.0 112.6 -173.36 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -74.64 -6.39 48.39 Favored 'General case' 0 CA--C 1.589 2.478 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 174.181 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.62 127.36 3.17 Favored 'General case' 0 CA--C 1.568 1.64 0 C-N-CA 127.302 2.241 . . . . 0.0 106.454 -174.292 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.0 m -68.29 133.57 91.33 Favored Pre-proline 0 CA--C 1.587 2.374 0 O-C-N 119.705 -1.872 . . . . 0.0 112.537 174.124 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -52.31 -0.72 0.06 OUTLIER 'Trans proline' 0 CA--C 1.57 2.279 1 N-CA-C 123.877 4.53 . . . . 0.0 123.877 -174.761 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 73.37 -40.34 0.46 Allowed 'General case' 0 N--CA 1.503 2.186 0 N-CA-C 119.019 2.97 . . . . 0.0 119.019 174.205 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.269 15.2 pt-20 -89.2 59.53 4.95 Favored 'General case' 0 CA--C 1.555 1.151 1 N-CA-C 125.568 5.396 . . . . 0.0 125.568 -172.118 . . . . . . . . 3 2 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.2 mtm105 -88.68 87.81 7.39 Favored 'General case' 0 N--CA 1.501 2.103 0 N-CA-C 104.959 -2.237 . . . . 0.0 104.959 168.001 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 78.8 25.25 60.65 Favored Glycine 0 CA--C 1.568 3.376 0 N-CA-C 116.705 1.442 . . . . 0.0 116.705 -170.943 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . 0.272 4.9 tt -142.13 -162.37 1.39 Allowed 'General case' 0 CA--C 1.581 2.143 0 C-N-CA 125.346 1.458 . . . . 0.0 109.576 -176.283 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -140.06 138.57 35.48 Favored 'General case' 0 CA--C 1.578 2.052 0 O-C-N 118.688 -2.507 . . . . 0.0 110.744 174.229 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 43.4 t -93.05 123.63 36.44 Favored 'General case' 0 CA--C 1.568 1.64 0 O-C-N 121.261 -0.899 . . . . 0.0 108.602 170.832 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 . . . . . 0 N--CA 1.497 1.881 0 O-C-N 120.138 -1.601 . . . . 0.0 110.378 179.433 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 . . . . . 0 N--CA 1.499 2.016 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -106.17 -165.04 22.99 Favored Glycine 0 N--CA 1.492 2.426 0 C-N-CA 123.572 0.605 . . . . 0.0 113.941 173.547 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 34.0 mm -121.56 142.79 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.251 0 CA-C-O 122.472 1.129 . . . . 0.0 110.429 178.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 82.8 m -67.91 118.09 10.66 Favored 'General case' 0 CA--C 1.57 1.714 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 174.033 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -142.64 139.62 31.32 Favored 'General case' 0 N--CA 1.483 1.175 0 O-C-N 120.548 -1.345 . . . . 0.0 107.879 173.853 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -94.41 70.6 3.7 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 123.949 1.833 . . . . 0.0 112.027 -175.9 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.5 m . . . . . 0 CA--C 1.569 1.691 0 CA-C-N 112.667 -2.061 . . . . 0.0 113.947 -175.265 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 . . . . . 0 CA--C 1.582 2.18 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 pp -128.44 169.22 14.56 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 116.022 1.86 . . . . 0.0 116.022 -174.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -75.0 169.77 17.34 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 115.702 1.741 . . . . 0.0 115.702 -173.026 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -75.08 153.36 38.39 Favored 'General case' 0 CA--C 1.575 1.931 0 CA-C-O 122.253 1.025 . . . . 0.0 112.452 176.921 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 92.43 23.29 26.95 Favored Glycine 0 N--CA 1.496 2.643 0 N-CA-C 116.706 1.442 . . . . 0.0 116.706 -173.066 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 -135.62 142.87 45.29 Favored 'General case' 0 CA--C 1.569 1.676 0 C-N-CA 124.773 1.229 . . . . 0.0 110.805 -177.917 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.4 tp -77.9 142.21 38.57 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -174.844 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.9 p -131.88 -178.58 4.95 Favored 'General case' 0 CA--C 1.575 1.936 0 CA-C-O 123.106 1.431 . . . . 0.0 114.601 -176.201 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.9 mt -107.79 -74.59 0.65 Allowed 'General case' 0 CA--C 1.574 1.902 0 N-CA-C 104.851 -2.277 . . . . 0.0 104.851 170.603 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -95.86 -168.59 1.79 Allowed 'General case' 0 CA--C 1.587 2.384 0 CA-C-N 119.986 1.266 . . . . 0.0 113.345 171.758 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.0 m -90.15 -9.47 48.15 Favored 'General case' 0 N--CA 1.507 2.425 0 N-CA-C 117.034 2.235 . . . . 0.0 117.034 174.291 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.73 10.35 2.26 Favored 'General case' 0 CA--C 1.577 2.005 0 N-CA-C 117.395 2.368 . . . . 0.0 117.395 175.24 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -94.2 -29.88 14.88 Favored 'General case' 0 CA--C 1.569 1.693 0 C-N-CA 124.807 1.243 . . . . 0.0 113.821 176.866 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . 0.259 80.4 m -81.99 -172.72 4.09 Favored 'General case' 0 CA--C 1.585 2.314 0 CA-C-N 121.866 2.121 . . . . 0.0 111.382 173.035 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -56.11 -69.87 0.13 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 119.345 -2.097 . . . . 0.0 116.646 -172.014 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.0 t -86.86 -72.51 0.5 Allowed 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 122.053 0.93 . . . . 0.0 111.443 174.315 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -172.17 63.96 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.937 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.63 -174.017 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 37.5 t -139.74 71.84 1.39 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 119.368 -2.082 . . . . 0.0 116.378 -173.731 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.3 t -98.03 123.86 42.25 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 170.637 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -103.23 120.3 40.48 Favored 'General case' 0 CA--C 1.573 1.835 0 CA-C-O 122.956 1.36 . . . . 0.0 114.053 -172.456 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -86.07 133.37 33.9 Favored 'General case' 0 CA--C 1.562 1.422 0 C-N-CA 125.322 1.449 . . . . 0.0 112.389 -177.482 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -82.69 59.04 4.53 Favored 'General case' 0 CA--C 1.58 2.119 0 O-C-N 120.63 -1.294 . . . . 0.0 114.39 173.935 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.256 6.0 t 48.38 88.55 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.316 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 175.857 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.3 4.2 mp 73.92 -57.57 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.633 0 C-N-CA 125.419 1.488 . . . . 0.0 111.325 -178.734 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.0 mt -62.29 114.28 3.38 Favored 'General case' 0 N--CA 1.496 1.873 0 CA-C-N 120.833 1.651 . . . . 0.0 109.572 173.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.0 p -85.46 50.04 1.88 Allowed 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 120.257 3.429 . . . . 0.0 120.257 -171.135 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.3 tt -92.37 85.92 5.53 Favored 'General case' 0 N--CA 1.498 1.955 0 N-CA-C 101.799 -3.408 . . . . 0.0 101.799 169.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 51.0 m -94.75 109.59 21.53 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 122.464 1.126 . . . . 0.0 112.889 -170.545 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 29.9 ttt85 -123.94 135.5 53.71 Favored 'General case' 0 CA--C 1.562 1.414 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.267 -175.357 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 95.1 m -65.65 145.15 56.39 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 123.779 1.752 . . . . 0.0 114.103 -179.695 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -138.09 -173.08 3.42 Favored 'General case' 0 CA--C 1.566 1.564 0 CA-C-N 113.535 -1.666 . . . . 0.0 112.887 -174.177 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 pp -80.62 151.51 28.99 Favored 'General case' 0 CA--C 1.572 1.791 0 CA-C-O 122.86 1.314 . . . . 0.0 113.506 175.395 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.1 pttt -80.94 143.27 32.74 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 123.616 0.766 . . . . 0.0 110.591 173.66 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.01 152.68 38.7 Favored 'General case' 0 CA--C 1.568 1.669 0 N-CA-C 118.108 2.633 . . . . 0.0 118.108 -171.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -102.7 170.23 8.14 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 113.141 -1.845 . . . . 0.0 112.683 -178.533 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -50.18 130.11 22.18 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 115.176 1.547 . . . . 0.0 115.176 -174.727 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 69.32 31.63 3.82 Favored 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -173.35 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 43.4 m -129.8 153.76 47.92 Favored 'General case' 0 CA--C 1.566 1.583 0 CA-C-O 122.763 1.268 . . . . 0.0 111.345 174.98 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -74.72 115.0 13.81 Favored 'General case' 0 CA--C 1.571 1.769 0 CA-C-O 123.462 1.601 . . . . 0.0 113.537 -176.579 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 13.7 p -111.18 152.75 26.69 Favored 'General case' 0 CA--C 1.562 1.439 0 CA-C-N 113.596 -1.638 . . . . 0.0 112.229 174.57 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.9 m -77.46 108.36 10.57 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.363 -1.461 . . . . 0.0 107.546 174.292 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.94 -54.43 7.24 Favored 'General case' 0 CA--C 1.564 1.497 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -172.557 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -93.28 138.32 31.76 Favored 'General case' 0 CA--C 1.565 1.531 0 CA-C-N 118.582 0.628 . . . . 0.0 109.508 173.641 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.8 p -110.34 142.32 42.15 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 123.441 1.591 . . . . 0.0 111.901 178.138 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.72 -144.03 0.3 Allowed 'General case' 0 CA--C 1.568 1.664 0 CA-C-N 113.203 -1.817 . . . . 0.0 108.902 174.115 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -121.21 75.38 1.16 Allowed 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 103.729 -2.693 . . . . 0.0 103.729 171.474 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 174.32 -162.35 32.66 Favored Glycine 0 N--CA 1.485 1.934 0 CA-C-O 122.908 1.282 . . . . 0.0 116.295 -174.549 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.6 t -79.29 145.51 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 CA-C-O 122.841 1.305 . . . . 0.0 111.336 -176.032 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -115.35 138.78 50.61 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.016 -173.845 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -66.06 -30.83 71.42 Favored 'General case' 0 CA--C 1.587 2.386 0 O-C-N 120.034 -1.667 . . . . 0.0 115.332 -176.164 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.5 mtmm -153.82 113.49 3.83 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 102.902 -2.999 . . . . 0.0 102.902 172.794 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 67.9 m -39.85 150.23 0.26 Allowed Pre-proline 0 CA--C 1.599 2.837 0 N-CA-C 119.919 3.303 . . . . 0.0 119.919 -173.521 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -69.1 58.46 1.24 Allowed 'Trans proline' 0 CA--C 1.579 2.765 0 N-CA-C 121.674 3.682 . . . . 0.0 121.674 -173.822 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 3.4 t 61.34 162.7 0.07 Allowed 'General case' 0 CA--C 1.582 2.201 0 N-CA-C 117.823 2.527 . . . . 0.0 117.823 174.182 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -75.63 160.37 30.17 Favored 'General case' 0 CA--C 1.574 1.888 0 N-CA-C 115.494 1.665 . . . . 0.0 115.494 178.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -63.23 120.35 11.37 Favored 'General case' 0 CA--C 1.572 1.818 0 CA-C-O 122.553 1.168 . . . . 0.0 113.073 -179.111 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.19 -28.26 15.91 Favored Glycine 0 N--CA 1.498 2.81 0 N-CA-C 116.846 1.498 . . . . 0.0 116.846 -173.219 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.4 mp -98.65 144.9 27.42 Favored 'General case' 0 CA--C 1.565 1.539 0 CA-C-O 122.412 1.101 . . . . 0.0 111.944 -179.128 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.78 153.59 18.64 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 122.083 0.944 . . . . 0.0 112.489 -178.708 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 5.1 t -92.77 96.52 10.2 Favored 'General case' 0 CA--C 1.57 1.719 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.825 174.717 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 . . . . . 0 CA--C 1.57 1.738 0 O-C-N 120.436 -1.415 . . . . 0.0 113.431 -173.966 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 . . . . . 0 CA--C 1.559 1.327 0 N-CA-C 115.528 1.677 . . . . 0.0 115.528 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -108.12 166.75 13.09 Favored Glycine 0 CA--C 1.548 2.154 0 CA-C-N 113.596 -1.638 . . . . 0.0 109.443 170.055 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 38.2 mm -102.37 135.59 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 120.23 -1.747 . . . . 0.0 109.322 179.019 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 28.6 m -62.98 119.52 9.6 Favored 'General case' 0 CA--C 1.572 1.791 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 174.235 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -139.58 153.63 47.43 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 122.452 1.12 . . . . 0.0 109.775 174.902 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -94.22 69.6 3.75 Favored 'General case' 0 N--CA 1.496 1.858 0 CA-C-O 124.02 1.867 . . . . 0.0 115.688 -172.272 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.4 t . . . . . 0 N--CA 1.502 2.14 0 CA-C-N 112.89 -1.959 . . . . 0.0 112.572 174.752 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 . . . . . 0 N--CA 1.505 2.281 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -122.11 151.18 41.2 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 123.866 1.794 . . . . 0.0 115.61 -179.214 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -83.0 166.46 18.79 Favored 'General case' 0 CA--C 1.572 1.819 0 CA-C-N 114.503 -1.226 . . . . 0.0 112.59 173.931 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.44 149.18 33.3 Favored 'General case' 0 CA--C 1.578 2.029 0 O-C-N 120.658 -1.276 . . . . 0.0 109.879 173.677 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.8 30.42 18.06 Favored Glycine 0 CA--C 1.559 2.84 0 O-C-N 121.236 -0.915 . . . . 0.0 114.979 -171.724 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -137.27 141.41 41.97 Favored 'General case' 0 CA--C 1.565 1.542 0 C-N-CA 125.024 1.33 . . . . 0.0 109.528 -174.024 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.7 tt -69.63 117.73 11.6 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.906 -1.121 . . . . 0.0 111.785 -179.054 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 39' ' ' CYS . 22.0 p -124.98 155.68 39.26 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 122.083 0.944 . . . . 0.0 113.222 -175.654 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.1 mp -91.4 -77.48 0.42 Allowed 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 173.841 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -92.38 164.9 13.32 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 115.504 1.668 . . . . 0.0 115.504 174.968 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.3 m -70.6 -22.78 62.51 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 116.474 2.028 . . . . 0.0 116.474 175.434 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.89 6.84 5.52 Favored 'General case' 0 CA--C 1.58 2.111 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 173.095 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -91.82 -41.49 10.62 Favored 'General case' 0 CA--C 1.565 1.527 0 C-N-CA 124.67 1.188 . . . . 0.0 111.899 174.148 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 74.4 m -77.41 136.77 38.43 Favored 'General case' 0 CA--C 1.571 1.787 0 CA-C-N 121.082 1.764 . . . . 0.0 110.476 174.05 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -44.58 -37.43 3.58 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 120.976 3.695 . . . . 0.0 120.976 -172.247 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.2 m -80.69 -83.26 0.11 Allowed 'General case' 0 CA--C 1.57 1.718 0 CA-C-N 118.472 0.578 . . . . 0.0 110.361 173.928 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -175.77 31.08 0.0 OUTLIER 'General case' 0 CA--C 1.588 2.431 0 C-N-CA 124.497 1.119 . . . . 0.0 113.138 -178.255 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 36.7 t -134.9 102.24 5.17 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 118.989 2.959 . . . . 0.0 118.989 -170.506 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 49.5 t -106.03 113.42 26.95 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 102.568 -3.123 . . . . 0.0 102.568 169.018 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.15 123.82 42.39 Favored 'General case' 0 CA--C 1.564 1.484 0 CA-C-O 122.059 0.933 . . . . 0.0 112.297 -173.065 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 20.4 t-80 -77.92 165.45 24.08 Favored 'General case' 0 CA--C 1.567 1.63 0 CA-C-O 122.656 1.217 . . . . 0.0 114.052 -174.742 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -80.35 -101.82 0.03 OUTLIER 'General case' 0 CA--C 1.577 2.006 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 172.631 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.1 p -150.77 90.93 1.67 Allowed 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 120.498 1.499 . . . . 0.0 108.112 174.148 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.271 5.9 mt 70.58 -31.6 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.512 2.67 0 N-CA-C 115.943 1.831 . . . . 0.0 115.943 174.603 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.4 tp -76.62 -123.31 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.151 0 CA-C-N 121.724 2.056 . . . . 0.0 111.03 174.938 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.0 p -162.05 92.82 0.86 Allowed 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 122.433 2.379 . . . . 0.0 114.986 178.11 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.0 tp -150.86 83.83 1.34 Allowed 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 104.067 -2.568 . . . . 0.0 104.067 172.746 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.8 m -104.5 131.34 51.99 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 122.646 1.213 . . . . 0.0 112.795 -173.29 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -131.71 134.82 46.32 Favored 'General case' 0 CA--C 1.562 1.419 0 C-N-CA 124.53 1.132 . . . . 0.0 108.951 -178.659 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 17' ' ' CYS . 99.4 m -65.26 146.92 54.32 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 119.874 -1.766 . . . . 0.0 113.9 178.409 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.42 179.73 6.49 Favored 'General case' 0 CA--C 1.564 1.513 0 CA-C-N 113.979 -1.464 . . . . 0.0 114.025 -173.368 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 98.1 mt -81.26 149.25 29.08 Favored 'General case' 0 CA--C 1.568 1.664 0 CA-C-O 122.097 0.951 . . . . 0.0 112.492 176.118 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -75.99 153.38 36.57 Favored 'General case' 0 CA--C 1.573 1.855 0 CA-C-O 121.856 0.836 . . . . 0.0 111.458 173.943 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.61 157.4 31.95 Favored 'General case' 0 CA--C 1.568 1.655 0 N-CA-C 116.856 2.169 . . . . 0.0 116.856 -173.252 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 43.2 mtp180 -117.58 172.03 7.62 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 113.257 -1.792 . . . . 0.0 111.308 179.45 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -48.59 132.46 17.33 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 116.216 1.932 . . . . 0.0 116.216 -172.972 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 m120 72.75 18.42 4.19 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -173.934 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.4 t -114.45 151.71 32.76 Favored 'General case' 0 CA--C 1.567 1.632 0 CA-C-O 123.11 1.433 . . . . 0.0 112.599 176.096 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -76.74 101.79 5.96 Favored 'General case' 0 CA--C 1.57 1.718 0 C-N-CA 124.86 1.264 . . . . 0.0 113.291 -177.706 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.05 156.52 16.89 Favored 'General case' 0 CA--C 1.564 1.493 0 CA-C-O 123.09 1.424 . . . . 0.0 113.793 177.254 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.1 t -82.46 96.9 8.15 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 171.522 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.6 -47.42 40.54 Favored 'General case' 0 CA--C 1.566 1.583 0 N-CA-C 115.926 1.825 . . . . 0.0 115.926 -173.304 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -89.03 153.12 21.26 Favored 'General case' 0 CA--C 1.57 1.746 0 C-N-CA 123.792 0.837 . . . . 0.0 109.547 172.904 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.1 p -126.27 146.74 49.88 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 123.946 1.831 . . . . 0.0 111.86 176.775 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -105.79 -53.0 2.72 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-N 112.869 -1.969 . . . . 0.0 113.355 175.144 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -164.76 -54.45 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.915 0 C-N-CA 127.14 2.176 . . . . 0.0 107.761 -174.875 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 112.01 94.36 2.19 Favored Glycine 0 N--CA 1.474 1.2 0 N-CA-C 116.916 1.526 . . . . 0.0 116.916 174.513 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.6 t -115.79 140.22 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 119.427 -2.219 . . . . 0.0 107.132 110.157 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -116.9 135.86 53.4 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -172.286 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -64.36 -41.48 96.71 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.616 -1.302 . . . . 0.0 113.377 174.23 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -142.2 110.59 6.05 Favored 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 103.549 -2.759 . . . . 0.0 103.549 172.503 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 57.1 m -53.02 161.5 1.22 Allowed Pre-proline 0 CA--C 1.588 2.427 0 N-CA-C 118.262 2.69 . . . . 0.0 118.262 -174.817 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -53.86 172.34 0.27 Allowed 'Trans proline' 0 CA--C 1.573 2.436 0 C-N-CA 122.954 2.436 . . . . 0.0 117.984 174.917 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 63.0 m -71.5 147.33 47.86 Favored 'General case' 0 CA--C 1.569 1.703 0 O-C-N 120.849 -1.157 . . . . 0.0 113.388 174.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -65.46 153.12 42.27 Favored 'General case' 0 CA--C 1.572 1.825 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 179.006 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 38.7 ttp180 -40.42 -35.65 0.46 Allowed 'General case' 0 N--CA 1.507 2.411 0 N-CA-C 121.574 3.916 . . . . 0.0 121.574 -174.606 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.42 -25.06 74.98 Favored Glycine 0 CA--C 1.555 2.551 0 N-CA-C 119.985 2.754 . . . . 0.0 119.985 173.933 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -135.28 169.22 17.81 Favored 'General case' 0 CA--C 1.574 1.883 0 CA-C-N 120.21 2.005 . . . . 0.0 114.159 179.16 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -98.68 158.17 15.79 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 -173.707 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.7 t -94.86 128.3 41.51 Favored 'General case' 0 CA--C 1.57 1.723 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.046 171.451 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 . . . . . 0 N--CA 1.493 1.722 0 O-C-N 120.006 -1.684 . . . . 0.0 108.152 -178.126 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 116.405 2.002 . . . . 0.0 116.405 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -107.72 151.03 16.96 Favored Glycine 0 CA--C 1.548 2.125 0 CA-C-N 114.458 -1.246 . . . . 0.0 111.19 173.453 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 24.7 mm -92.52 134.91 29.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 120.099 -1.824 . . . . 0.0 110.583 -166.464 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 98.8 m -63.98 123.59 19.39 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 175.013 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -143.73 151.63 40.27 Favored 'General case' 0 CA--C 1.563 1.449 0 CA-C-O 123.612 1.672 . . . . 0.0 110.532 174.875 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -98.08 79.72 2.63 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 124.422 2.058 . . . . 0.0 111.26 -176.071 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.9 t . . . . . 0 CA--C 1.569 1.707 0 CA-C-N 112.012 -2.358 . . . . 0.0 108.056 -175.636 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 69.4 t . . . . . 0 CA--C 1.58 2.132 0 CA-C-O 115.737 -2.078 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.86 98.04 1.04 Allowed 'Trans proline' 0 CA--C 1.569 2.271 0 CA-C-N 125.698 3.071 . . . . 0.0 113.726 178.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . 0.25 3.1 p30 43.33 69.97 2.07 Favored Pre-proline 0 CA--C 1.588 2.423 0 N-CA-C 117.818 2.525 . . . . 0.0 117.818 -178.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -76.57 80.85 2.66 Favored 'Trans proline' 0 CA--C 1.572 2.406 0 C-N-CA 122.711 2.274 . . . . 0.0 113.791 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . 0.259 37.6 ttp180 69.19 -73.82 0.09 Allowed 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 125.919 1.687 . . . . 0.0 112.443 -174.397 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 64.62 23.84 69.13 Favored Glycine 0 N--CA 1.499 2.856 0 N-CA-C 121.489 3.356 . . . . 0.0 121.489 176.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 13.0 mt -96.13 -14.29 7.91 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.486 0 CA-C-N 118.416 1.108 . . . . 0.0 113.594 -173.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 58.8 mt -71.16 120.83 19.89 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.297 0 O-C-N 119.25 -2.156 . . . . 0.0 110.654 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.291 1.7 pt -100.44 -127.7 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.222 0 C-N-CA 122.875 0.47 . . . . 0.0 111.957 -174.142 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -140.33 81.4 1.81 Allowed 'General case' 0 CA--C 1.579 2.093 0 N-CA-C 116.96 2.207 . . . . 0.0 116.96 -173.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mt -132.42 152.51 51.46 Favored 'General case' 0 N--CA 1.5 2.068 0 CA-C-O 123.695 1.712 . . . . 0.0 113.269 173.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -83.81 163.51 20.1 Favored 'General case' 0 CA--C 1.571 1.752 0 CA-C-N 114.375 -1.284 . . . . 0.0 113.612 177.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.77 137.79 38.64 Favored 'General case' 0 CA--C 1.579 2.062 0 O-C-N 120.867 -1.146 . . . . 0.0 108.011 172.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.33 1.22 44.19 Favored Glycine 0 CA--C 1.56 2.889 0 N-CA-C 115.866 1.106 . . . . 0.0 115.866 -171.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -113.34 149.81 33.48 Favored 'General case' 0 CA--C 1.572 1.807 0 CA-C-N 118.951 1.375 . . . . 0.0 110.283 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.4 tt -69.45 128.12 35.42 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 120.824 -1.172 . . . . 0.0 112.87 -176.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.9 p -128.97 151.78 49.31 Favored 'General case' 0 CA--C 1.562 1.404 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -177.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.9 mt -85.84 -81.5 0.21 Allowed 'General case' 0 CA--C 1.567 1.6 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 173.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -94.53 177.76 5.82 Favored 'General case' 0 N--CA 1.499 1.981 0 CA-C-N 119.311 0.959 . . . . 0.0 112.57 173.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -71.0 -6.19 36.99 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 173.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.31 7.18 4.56 Favored 'General case' 0 CA--C 1.571 1.771 0 N-CA-C 117.128 2.27 . . . . 0.0 117.128 172.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -91.72 -51.2 5.35 Favored 'General case' 0 CA--C 1.567 1.607 0 C-N-CA 124.116 0.966 . . . . 0.0 111.97 -177.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 80.0 m -82.6 147.69 28.44 Favored 'General case' 0 CA--C 1.558 1.267 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -53.56 -53.7 47.98 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 124.039 0.936 . . . . 0.0 111.082 173.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 65.3 m -83.27 104.31 13.33 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 103.568 -2.753 . . . . 0.0 103.568 168.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.87 80.42 0.46 Allowed 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 124.998 2.332 . . . . 0.0 114.624 -172.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.0 t -142.54 72.97 1.39 Allowed 'General case' 0 CA--C 1.56 1.352 0 CA-C-N 112.291 -2.231 . . . . 0.0 110.076 -174.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 34.6 t -78.74 111.38 14.8 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 104.746 -2.316 . . . . 0.0 104.746 172.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -100.42 115.62 30.45 Favored 'General case' 0 CA--C 1.567 1.627 0 CA-C-O 122.997 1.38 . . . . 0.0 114.332 -170.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -82.19 158.22 23.67 Favored 'General case' 0 CA--C 1.566 1.583 0 C-N-CA 126.047 1.739 . . . . 0.0 113.238 -178.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.3 -55.56 32.19 Favored 'General case' 0 CA--C 1.583 2.228 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 174.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.6 t 175.29 -38.88 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.518 0 C-N-CA 125.794 1.638 . . . . 0.0 111.838 -174.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 6.0 tp -157.28 -46.33 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.225 0 CA-C-N 119.95 1.25 . . . . 0.0 113.272 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.6 mt -77.07 -83.44 0.07 Allowed 'General case' 0 N--CA 1.497 1.888 0 CA-C-N 120.708 1.595 . . . . 0.0 112.91 -174.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 96.3 p -154.89 -123.65 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 121.332 1.878 . . . . 0.0 112.934 174.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.1 tt 53.96 80.72 0.11 Allowed 'General case' 0 N--CA 1.503 2.181 0 CA-C-N 120.325 1.42 . . . . 0.0 110.944 -173.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.5 m -117.06 107.65 14.78 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 122.947 1.356 . . . . 0.0 111.262 -174.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 20.7 ttp180 -125.93 141.37 52.01 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.682 1.193 . . . . 0.0 108.616 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 91.1 m -67.08 147.61 52.94 Favored 'General case' 0 CA--C 1.561 1.394 0 O-C-N 119.656 -1.903 . . . . 0.0 114.586 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.14 -177.82 5.18 Favored 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 113.262 -1.79 . . . . 0.0 112.303 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 35.5 tp -85.68 142.95 28.67 Favored 'General case' 0 CA--C 1.571 1.756 0 O-C-N 120.987 -1.071 . . . . 0.0 112.66 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -72.42 143.96 48.33 Favored 'General case' 0 CA--C 1.575 1.937 0 O-C-N 121.497 -0.752 . . . . 0.0 110.186 173.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.26 152.18 36.57 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 118.611 2.819 . . . . 0.0 118.611 -171.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.9 mmt180 -121.48 175.74 6.04 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-N 111.522 -2.581 . . . . 0.0 111.732 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -57.84 127.56 32.67 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -173.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 76.39 29.59 0.7 Allowed 'General case' 0 N--CA 1.504 2.268 0 C-N-CA 125.194 1.398 . . . . 0.0 113.593 -172.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.6 t -124.85 149.6 47.31 Favored 'General case' 0 CA--C 1.566 1.581 0 O-C-N 120.485 -1.385 . . . . 0.0 112.123 175.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -77.85 104.76 8.6 Favored 'General case' 0 CA--C 1.572 1.791 0 CA-C-O 123.533 1.635 . . . . 0.0 113.207 -177.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -101.22 167.58 10.11 Favored 'General case' 0 CA--C 1.575 1.911 0 C-N-CA 125.901 1.68 . . . . 0.0 111.794 173.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.0 t -86.51 -86.7 0.14 Allowed 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 104.984 -2.228 . . . . 0.0 104.984 170.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -156.34 -74.51 0.1 Allowed 'General case' 0 CA--C 1.565 1.557 0 CA-C-N 120.513 1.506 . . . . 0.0 112.606 172.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 23.3 p90 -137.58 177.53 7.8 Favored 'General case' 0 CA--C 1.574 1.875 0 C-N-CA 124.013 0.925 . . . . 0.0 111.548 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.1 p -87.89 135.22 33.49 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.599 -1.313 . . . . 0.0 113.634 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -100.98 -121.49 0.16 Allowed 'General case' 0 CA--C 1.566 1.563 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 172.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -144.64 74.36 1.41 Allowed 'General case' 0 CA--C 1.57 1.732 0 N-CA-C 103.663 -2.717 . . . . 0.0 103.663 171.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 168.2 -171.57 42.54 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 116.217 1.247 . . . . 0.0 116.217 -174.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.4 t -77.65 142.29 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 CA-C-O 122.779 1.276 . . . . 0.0 111.103 -172.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -115.37 126.55 54.55 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.075 -172.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -59.61 -40.99 89.37 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 175.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -142.49 113.24 7.42 Favored 'General case' 0 CA--C 1.56 1.365 0 N-CA-C 102.891 -3.003 . . . . 0.0 102.891 171.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 59.0 m -52.02 144.14 21.61 Favored Pre-proline 0 CA--C 1.586 2.358 0 N-CA-C 115.796 1.776 . . . . 0.0 115.796 -177.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -68.26 179.62 2.81 Favored 'Trans proline' 0 CA--C 1.568 2.187 0 C-N-CA 122.284 1.989 . . . . 0.0 116.411 -174.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 56.7 m -74.06 149.03 41.4 Favored 'General case' 0 CA--C 1.573 1.84 0 O-C-N 121.029 -1.044 . . . . 0.0 112.682 174.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.51 176.51 2.85 Favored 'General case' 0 CA--C 1.583 2.233 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 177.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.4 113.66 4.26 Favored 'General case' 0 CA--C 1.579 2.062 0 O-C-N 119.866 -1.771 . . . . 0.0 112.983 178.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 122.49 -39.11 2.36 Favored Glycine 0 N--CA 1.497 2.737 0 CA-C-N 113.923 -1.49 . . . . 0.0 116.079 -173.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 mp -98.4 151.77 20.2 Favored 'General case' 0 CA--C 1.567 1.604 0 CA-C-O 122.732 1.253 . . . . 0.0 112.704 -177.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -111.23 151.83 27.82 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.158 -0.964 . . . . 0.0 111.407 -179.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 4.0 t -90.65 117.76 29.56 Favored 'General case' 0 CA--C 1.569 1.685 0 C-N-CA 122.827 0.451 . . . . 0.0 111.991 175.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -97.29 93.62 6.62 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.617 -1.302 . . . . 0.0 109.86 -176.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.21 75.32 0.02 OUTLIER Glycine 0 N--CA 1.497 2.707 0 N-CA-C 121.57 3.388 . . . . 0.0 121.57 -173.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -81.06 11.67 3.93 Favored 'General case' 0 CA--C 1.586 2.358 0 N-CA-C 117.055 2.243 . . . . 0.0 117.055 172.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . 0.269 47.5 tptt 73.54 -60.37 0.53 Allowed 'General case' 0 N--CA 1.5 2.062 0 C-N-CA 126.063 1.745 . . . . 0.0 112.421 -173.059 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 32.6 t 44.06 80.6 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 116.095 1.887 . . . . 0.0 116.095 174.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -74.91 53.17 0.58 Allowed 'General case' 0 CA--C 1.578 2.044 0 N-CA-C 117.212 2.301 . . . . 0.0 117.212 -173.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 92.1 t -88.27 77.35 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 CA-C-O 123.508 1.623 . . . . 0.0 106.634 173.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.06 -16.81 0.31 Allowed Glycine 0 CA--C 1.558 2.761 0 N-CA-C 116.867 1.507 . . . . 0.0 116.867 -173.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.1 m 78.3 -60.67 0.4 Allowed 'General case' 0 N--CA 1.503 2.205 0 C-N-CA 126.189 1.796 . . . . 0.0 115.647 176.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.7 tp -139.42 123.98 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 CA-C-O 123.488 1.613 . . . . 0.0 109.013 -178.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 6.8 t -146.22 175.76 10.26 Favored 'General case' 0 CA--C 1.576 1.943 0 CA-C-N 113.769 -1.56 . . . . 0.0 112.583 179.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -104.78 27.04 8.41 Favored 'General case' 0 CA--C 1.585 2.326 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 172.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 13.2 t -142.27 -170.21 3.12 Favored 'General case' 0 CA--C 1.577 1.999 0 CA-C-O 125.707 2.67 . . . . 0.0 110.965 -174.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -130.01 125.79 36.17 Favored 'General case' 0 CA--C 1.567 1.631 0 CA-C-N 111.639 -2.528 . . . . 0.0 106.181 173.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -99.22 153.23 19.09 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 123.3 1.524 . . . . 0.0 111.402 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -153.71 168.25 32.21 Favored Glycine 0 N--CA 1.48 1.59 0 CA-C-N 115.246 -0.888 . . . . 0.0 114.735 -175.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 23.8 mm -97.9 132.43 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.15 -1.206 . . . . 0.0 109.577 -176.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.2 m -67.12 125.83 27.25 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 174.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -143.23 158.95 43.17 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 123.105 1.431 . . . . 0.0 111.832 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -93.81 74.66 4.25 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 123.54 1.638 . . . . 0.0 111.511 -174.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.4 p -134.46 -28.49 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 CA-C-N 113.693 -1.594 . . . . 0.0 115.048 -176.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.16 68.68 1.56 Allowed Glycine 0 N--CA 1.494 2.555 0 N-CA-C 116.185 1.234 . . . . 0.0 116.185 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . 0.308 47.3 ptt85 58.56 -42.02 0.06 Allowed 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 118.795 2.887 . . . . 0.0 118.795 -174.027 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.7 m . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 123.54 1.638 . . . . 0.0 110.553 178.729 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 CA--C 1.582 2.18 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.25 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -80.92 81.75 2.65 Favored 'Trans proline' 0 CA--C 1.57 2.309 0 C-N-CA 122.55 2.167 . . . . 0.0 114.222 -178.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 78.94 92.16 0.05 OUTLIER Pre-proline 0 CA--C 1.581 2.148 0 C-N-CA 126.3 1.84 . . . . 0.0 111.412 -176.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -54.4 -43.08 62.05 Favored 'Trans proline' 0 CA--C 1.57 2.316 0 N-CA-C 118.757 2.561 . . . . 0.0 118.757 176.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -131.58 90.82 2.9 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 174.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -151.3 80.82 0.19 Allowed Glycine 0 N--CA 1.491 2.338 0 O-C-N 121.394 -0.816 . . . . 0.0 114.825 -178.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 65.3 mt -97.22 84.94 1.38 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.055 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 174.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.392 20.4 pt 55.46 -121.16 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 C-N-CA 125.476 1.511 . . . . 0.0 111.764 -174.162 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -124.46 173.34 10.62 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.95 0 CA-C-N 120.237 1.38 . . . . 0.0 111.55 176.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -144.1 94.25 2.55 Favored 'General case' 0 CA--C 1.576 1.973 0 N-CA-C 116.959 2.207 . . . . 0.0 116.959 -172.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.2 tp -159.39 125.15 4.29 Favored 'General case' 0 CA--C 1.579 2.091 0 N-CA-C 105.744 -1.947 . . . . 0.0 105.744 173.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -80.44 165.52 22.12 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 118.874 -2.391 . . . . 0.0 113.486 -175.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.17 144.01 44.99 Favored 'General case' 0 CA--C 1.576 1.974 0 O-C-N 120.962 -1.086 . . . . 0.0 110.037 174.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.79 25.06 26.1 Favored Glycine 0 CA--C 1.563 3.042 0 N-CA-C 114.769 0.668 . . . . 0.0 114.769 -171.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -136.15 148.4 48.18 Favored 'General case' 0 CA--C 1.571 1.762 0 C-N-CA 125.462 1.505 . . . . 0.0 109.132 -178.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 tt -69.1 117.75 11.14 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.59 -1.319 . . . . 0.0 112.284 -176.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 26.5 p -117.42 152.88 34.08 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 121.797 0.808 . . . . 0.0 113.054 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.0 mp -89.87 -78.72 0.36 Allowed 'General case' 0 CA--C 1.568 1.64 0 N-CA-C 106.348 -1.723 . . . . 0.0 106.348 172.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -96.46 168.86 10.29 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 120.59 1.541 . . . . 0.0 114.512 174.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.5 t -70.25 -21.93 62.93 Favored 'General case' 0 N--CA 1.506 2.355 0 N-CA-C 116.332 1.975 . . . . 0.0 116.332 174.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.17 16.74 0.54 Allowed 'General case' 0 CA--C 1.575 1.919 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 174.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 67.7 mt-30 -104.29 -39.66 6.4 Favored 'General case' 0 CA--C 1.572 1.813 0 C-N-CA 125.005 1.322 . . . . 0.0 113.177 173.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.0 m -80.7 149.04 29.9 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 115.54 1.682 . . . . 0.0 115.54 -177.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -57.02 -54.55 45.44 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.114 0.966 . . . . 0.0 110.544 172.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 91.9 p -82.42 101.28 10.54 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 103.766 -2.679 . . . . 0.0 103.766 168.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -69.39 80.47 0.38 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 125.267 2.46 . . . . 0.0 113.89 -172.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.2 t -156.93 82.41 0.94 Allowed 'General case' 0 CA--C 1.56 1.354 0 CA-C-N 112.096 -2.32 . . . . 0.0 110.729 -173.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 29.7 t -81.5 109.08 15.63 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 105.418 -2.068 . . . . 0.0 105.418 172.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.58 123.29 34.11 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-O 122.453 1.12 . . . . 0.0 112.726 -172.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -82.02 149.04 28.31 Favored 'General case' 0 CA--C 1.559 1.296 0 CA-C-O 122.707 1.241 . . . . 0.0 113.732 -178.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -65.92 -1.26 2.84 Favored 'General case' 0 CA--C 1.585 2.317 0 N-CA-C 116.279 1.955 . . . . 0.0 116.279 171.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.266 64.9 p 68.84 85.75 0.14 Allowed 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 127.192 2.197 . . . . 0.0 110.384 -178.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.276 5.3 mp 77.41 140.78 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.587 2.379 0 C-N-CA 125.426 1.49 . . . . 0.0 109.364 -173.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.309 10.0 tp 84.94 -138.24 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.103 0 C-N-CA 126.455 1.902 . . . . 0.0 109.19 -174.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 96.4 p -165.3 96.61 0.69 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 121.445 1.929 . . . . 0.0 114.218 178.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 54.6 tp -150.35 89.25 1.56 Allowed 'General case' 0 CA--C 1.564 1.503 0 N-CA-C 103.925 -2.62 . . . . 0.0 103.925 173.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.8 m -104.51 132.85 50.28 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 122.832 1.301 . . . . 0.0 113.394 -172.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -136.93 133.56 35.82 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.528 1.131 . . . . 0.0 108.822 -177.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 55.2 m -66.57 146.46 54.48 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 124.341 2.019 . . . . 0.0 113.703 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -138.25 -178.08 5.12 Favored 'General case' 0 CA--C 1.564 1.483 0 CA-C-N 112.615 -2.084 . . . . 0.0 112.338 -174.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.5 tp -83.83 125.09 31.62 Favored 'General case' 0 CA--C 1.569 1.706 0 O-C-N 121.313 -0.867 . . . . 0.0 111.05 174.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -61.02 148.5 39.98 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 123.891 0.876 . . . . 0.0 112.508 174.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.21 152.53 42.17 Favored 'General case' 0 CA--C 1.564 1.517 0 N-CA-C 118.529 2.788 . . . . 0.0 118.529 -170.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.63 168.09 9.31 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 112.82 -1.991 . . . . 0.0 111.45 -174.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -51.59 139.42 20.57 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -178.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.354 10.9 p30 57.75 28.9 16.57 Favored 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -172.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.9 m -129.43 153.1 48.27 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-O 122.691 1.234 . . . . 0.0 110.55 174.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -69.5 137.27 52.4 Favored 'General case' 0 CA--C 1.578 2.044 0 CA-C-O 124.631 2.158 . . . . 0.0 115.354 -175.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 27.3 p -142.0 147.59 37.16 Favored 'General case' 0 CA--C 1.566 1.592 0 CA-C-N 112.241 -2.254 . . . . 0.0 110.691 -178.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 60.2 m -77.62 104.48 8.18 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 119.707 -1.871 . . . . 0.0 108.025 174.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.85 43.93 0.52 Allowed 'General case' 0 CA--C 1.573 1.855 0 N-CA-C 118.732 2.864 . . . . 0.0 118.732 -173.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.9 p90 -164.29 138.01 5.3 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 126.096 1.758 . . . . 0.0 107.834 -174.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.5 p -114.21 137.68 51.46 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-O 122.883 1.325 . . . . 0.0 109.96 174.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.275 2.1 pp -96.22 -78.74 0.46 Allowed 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 113.821 -1.536 . . . . 0.0 108.48 176.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -159.84 -14.67 0.06 Allowed 'General case' 0 CA--C 1.587 2.378 0 C-N-CA 125.584 1.554 . . . . 0.0 112.757 176.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -164.59 -93.05 0.09 OUTLIER Glycine 0 N--CA 1.478 1.496 0 O-C-N 120.127 -1.608 . . . . 0.0 115.87 -174.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 1.9 t -79.28 143.94 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.191 0 CA-C-N 119.18 1.49 . . . . 0.0 112.243 -164.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -126.86 144.05 51.09 Favored 'General case' 0 CA--C 1.56 1.346 0 N-CA-C 114.96 1.466 . . . . 0.0 114.96 -172.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -69.65 -44.65 70.14 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.832 173.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -139.13 115.86 10.74 Favored 'General case' 0 CA--C 1.565 1.553 0 N-CA-C 102.783 -3.043 . . . . 0.0 102.783 173.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 58.2 m -53.5 145.71 27.16 Favored Pre-proline 0 CA--C 1.591 2.548 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 -174.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -79.0 65.57 8.85 Favored 'Trans proline' 0 CA--C 1.571 2.372 0 C-N-CA 123.498 2.799 . . . . 0.0 117.42 -173.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 58.1 m 58.97 165.17 0.05 OUTLIER 'General case' 0 CA--C 1.579 2.086 0 N-CA-C 117.048 2.24 . . . . 0.0 117.048 176.221 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -72.61 149.71 43.7 Favored 'General case' 0 CA--C 1.567 1.627 0 O-C-N 120.818 -1.176 . . . . 0.0 112.978 174.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.73 103.98 0.98 Allowed 'General case' 0 N--CA 1.499 2.003 0 CA-C-O 122.83 1.3 . . . . 0.0 112.368 -174.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 131.09 -32.01 3.07 Favored Glycine 0 CA--C 1.558 2.774 0 CA-C-N 114.344 -1.298 . . . . 0.0 114.58 -171.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mp -96.77 151.5 19.58 Favored 'General case' 0 CA--C 1.566 1.59 0 CA-C-O 122.77 1.271 . . . . 0.0 111.456 172.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -99.36 154.53 18.12 Favored 'General case' 0 CA--C 1.562 1.404 0 CA-C-O 122.291 1.043 . . . . 0.0 112.142 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 17.2 t -93.71 118.43 31.4 Favored 'General case' 0 CA--C 1.569 1.68 0 CA-C-N 115.327 -0.851 . . . . 0.0 108.79 172.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -96.88 99.01 10.58 Favored 'General case' 0 CA--C 1.57 1.732 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -172.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.07 124.87 3.11 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 117.491 1.756 . . . . 0.0 117.491 173.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -55.61 -45.55 77.47 Favored 'General case' 0 N--CA 1.504 2.233 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 172.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp 55.74 -103.25 0.17 Allowed 'General case' 0 N--CA 1.5 2.061 0 C-N-CA 125.597 1.559 . . . . 0.0 113.454 174.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.9 m 68.93 105.15 0.06 Allowed 'General case' 0 CA--C 1.567 1.633 0 C-N-CA 126.237 1.815 . . . . 0.0 113.407 174.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.9 mt -69.69 100.29 1.46 Allowed 'General case' 0 N--CA 1.49 1.552 0 CA-C-O 122.474 1.13 . . . . 0.0 110.813 176.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.2 p -71.56 69.38 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.586 2.363 0 CA-C-O 124.762 2.22 . . . . 0.0 112.83 175.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 157.72 54.09 0.01 OUTLIER Glycine 0 CA--C 1.552 2.394 0 CA-C-N 113.531 -1.668 . . . . 0.0 111.749 -174.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.5 m -171.64 140.66 1.37 Allowed 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 125.245 1.418 . . . . 0.0 108.215 -171.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 18.5 pt -78.96 -47.81 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 N-CA-C 117.384 2.364 . . . . 0.0 117.384 -173.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 80.3 p -133.63 -69.61 0.54 Allowed 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 117.108 2.262 . . . . 0.0 117.108 -172.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -84.61 87.89 7.3 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 103.297 -2.853 . . . . 0.0 103.297 172.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . 0.281 18.6 p -95.04 -92.58 0.2 Allowed 'General case' 0 CA--C 1.56 1.348 0 CA-C-N 114.435 -1.257 . . . . 0.0 109.349 -170.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -161.6 85.48 0.64 Allowed 'General case' 0 N--CA 1.495 1.792 0 CA-C-N 120.722 1.601 . . . . 0.0 108.649 173.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 99.5 m-85 -95.71 161.98 13.8 Favored 'General case' 0 CA--C 1.573 1.861 0 O-C-N 120.749 -1.22 . . . . 0.0 111.816 -174.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -55.96 154.11 14.81 Favored Glycine 0 N--CA 1.499 2.87 0 N-CA-C 117.712 1.845 . . . . 0.0 117.712 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 42.6 mm -99.8 137.13 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 O-C-N 120.668 -1.489 . . . . 0.0 110.804 -172.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 67.3 m -68.72 124.25 23.14 Favored 'General case' 0 CA--C 1.572 1.814 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 174.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 69.9 m-70 -141.47 163.11 33.82 Favored 'General case' 0 CA--C 1.565 1.539 0 O-C-N 120.628 -1.295 . . . . 0.0 111.048 178.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -95.82 85.45 4.11 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 123.483 1.611 . . . . 0.0 111.981 -175.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 48.0 t -126.42 77.65 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 CA-C-N 113.535 -1.666 . . . . 0.0 106.862 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -84.83 -60.02 1.92 Allowed Glycine 0 N--CA 1.495 2.627 0 N-CA-C 117.613 1.805 . . . . 0.0 117.613 -175.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 53.0 ttp180 -137.04 -67.77 0.49 Allowed 'General case' 0 N--CA 1.497 1.882 0 CA-C-N 117.864 0.832 . . . . 0.0 111.862 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.7 t . . . . . 0 N--CA 1.501 2.085 0 N-CA-C 115.667 1.729 . . . . 0.0 115.667 -178.598 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 88.4 t . . . . . 0 CA--C 1.578 2.051 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -84.62 59.54 5.72 Favored 'Trans proline' 0 CA--C 1.572 2.424 0 CA-C-N 122.733 2.012 . . . . 0.0 114.963 -178.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -162.52 126.34 1.9 Allowed Pre-proline 0 CA--C 1.578 2.029 0 O-C-N 120.928 -1.107 . . . . 0.0 110.192 -176.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -80.32 76.31 4.6 Favored 'Trans proline' 0 CA--C 1.572 2.422 0 CA-C-N 123.177 2.17 . . . . 0.0 114.424 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -135.0 91.61 2.77 Favored 'General case' 0 CA--C 1.565 1.53 0 CA-C-O 121.88 0.848 . . . . 0.0 109.77 -177.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.8 -51.86 37.75 Favored Glycine 0 N--CA 1.498 2.8 0 N-CA-C 118.017 1.967 . . . . 0.0 118.017 175.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . 0.307 6.6 tp 42.1 34.16 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.549 0 N-CA-C 120.005 3.335 . . . . 0.0 120.005 170.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 18.0 tt -95.33 116.39 36.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 119.955 -1.716 . . . . 0.0 111.418 -174.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.253 15.1 pt -105.36 -105.12 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.666 -0.646 . . . . 0.0 109.394 176.584 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.304 1.0 OUTLIER 54.18 53.16 11.42 Favored 'General case' 0 N--CA 1.507 2.39 0 N-CA-C 118.918 2.933 . . . . 0.0 118.918 174.949 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.1 mp -99.01 123.07 43.05 Favored 'General case' 0 CA--C 1.567 1.625 0 CA-C-O 122.778 1.275 . . . . 0.0 112.052 175.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -84.78 169.92 13.73 Favored 'General case' 0 CA--C 1.574 1.892 0 O-C-N 121.129 -0.982 . . . . 0.0 111.087 172.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.77 123.58 17.44 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.621 -1.3 . . . . 0.0 111.471 175.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 111.12 -6.2 28.83 Favored Glycine 0 CA--C 1.559 2.804 0 N-CA-C 117.157 1.623 . . . . 0.0 117.157 -172.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -99.09 135.73 40.08 Favored 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 119.635 1.718 . . . . 0.0 111.857 -178.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.6 tt -76.04 128.04 34.2 Favored 'General case' 0 CA--C 1.575 1.924 0 O-C-N 121.46 -0.775 . . . . 0.0 112.183 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.6 p -120.7 -171.78 2.25 Favored 'General case' 0 CA--C 1.577 1.998 0 CA-C-O 123.206 1.479 . . . . 0.0 114.702 -174.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.6 mt -112.29 -75.92 0.6 Allowed 'General case' 0 CA--C 1.578 2.025 0 N-CA-C 103.815 -2.661 . . . . 0.0 103.815 169.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.1 p30 -93.91 -177.67 4.41 Favored 'General case' 0 CA--C 1.589 2.47 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 172.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.0 m -84.95 -17.66 36.99 Favored 'General case' 0 N--CA 1.508 2.428 0 N-CA-C 116.289 1.959 . . . . 0.0 116.289 173.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.25 7.4 2.82 Favored 'General case' 0 CA--C 1.583 2.241 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 173.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -94.4 -40.78 9.75 Favored 'General case' 0 CA--C 1.568 1.66 0 C-N-CA 126.17 1.788 . . . . 0.0 110.862 173.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.7 m -76.24 117.18 17.66 Favored 'General case' 0 CA--C 1.566 1.586 0 CA-C-N 119.449 1.022 . . . . 0.0 109.604 173.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -77.63 9.56 3.3 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 118.007 2.595 . . . . 0.0 118.007 -174.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 65.0 p -81.15 -88.32 0.08 Allowed 'General case' 0 CA--C 1.581 2.152 0 N-CA-C 104.346 -2.464 . . . . 0.0 104.346 169.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -171.41 25.71 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.167 0 C-N-CA 125.996 1.718 . . . . 0.0 111.056 171.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 5.9 t -161.51 120.57 2.46 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 119.003 2.964 . . . . 0.0 119.003 -170.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 35.4 t -103.4 119.99 39.94 Favored 'General case' 0 CA--C 1.56 1.352 0 N-CA-C 102.651 -3.092 . . . . 0.0 102.651 167.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -93.31 115.37 27.95 Favored 'General case' 0 CA--C 1.562 1.425 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 -172.191 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -84.04 114.6 21.85 Favored 'General case' 0 CA--C 1.567 1.596 0 C-N-CA 124.55 1.14 . . . . 0.0 112.228 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -82.78 89.75 6.82 Favored 'General case' 0 CA--C 1.571 1.768 0 O-C-N 119.927 -1.733 . . . . 0.0 111.439 174.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.305 5.6 t 52.6 -177.0 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -176.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 28.5 mm -57.65 -28.78 32.91 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.607 0 O-C-N 118.937 -2.352 . . . . 0.0 114.812 -179.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.6 mt -51.98 -21.91 3.5 Favored 'General case' 0 N--CA 1.503 2.177 0 N-CA-C 118.544 2.794 . . . . 0.0 118.544 174.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.406 39.2 p 100.19 -122.65 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 127.67 2.388 . . . . 0.0 112.187 174.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 31.0 tp 45.48 76.84 0.09 Allowed 'General case' 0 N--CA 1.504 2.233 0 CA-C-N 120.426 1.466 . . . . 0.0 112.978 -173.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 48.6 m -98.14 108.23 20.89 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-O 122.023 0.916 . . . . 0.0 112.51 -172.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 34.2 ttm105 -118.17 136.55 53.56 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 124.091 0.956 . . . . 0.0 110.331 -176.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 62.6 m -62.92 154.21 31.01 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 117.59 2.441 . . . . 0.0 117.59 -174.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.95 -175.8 4.36 Favored 'General case' 0 CA--C 1.572 1.791 0 CA-C-N 112.713 -2.04 . . . . 0.0 112.443 -177.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.8 tp -116.88 171.88 7.61 Favored 'General case' 0 CA--C 1.572 1.821 0 O-C-N 121.204 -0.935 . . . . 0.0 110.929 176.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -56.32 145.35 27.27 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.814 -1.179 . . . . 0.0 113.706 174.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.1 149.62 35.7 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-O 123.928 1.823 . . . . 0.0 115.267 -174.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 44.4 mtp180 -107.68 169.19 8.74 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-N 112.715 -2.039 . . . . 0.0 111.731 -178.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -51.18 125.52 14.19 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -174.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 77.84 7.76 2.6 Favored 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -173.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.0 t -102.46 157.25 17.05 Favored 'General case' 0 CA--C 1.564 1.498 0 CA-C-O 123.104 1.431 . . . . 0.0 112.472 174.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -76.96 107.11 9.07 Favored 'General case' 0 CA--C 1.567 1.629 0 CA-C-O 123.218 1.485 . . . . 0.0 114.477 -173.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 23.1 p -114.96 147.61 39.81 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 113.373 -1.739 . . . . 0.0 113.237 176.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.0 t -104.8 130.82 52.83 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 170.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.85 -39.11 66.79 Favored 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 176.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -95.01 160.13 14.71 Favored 'General case' 0 CA--C 1.574 1.871 0 C-N-CA 125.541 1.536 . . . . 0.0 110.18 172.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 35.7 p -128.98 152.32 48.72 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-O 123.592 1.663 . . . . 0.0 110.434 173.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -97.38 -59.35 1.8 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 114.133 -1.394 . . . . 0.0 112.187 175.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -164.68 -52.31 0.03 OUTLIER 'General case' 0 CA--C 1.572 1.804 0 C-N-CA 126.195 1.798 . . . . 0.0 109.476 -176.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 100.69 102.4 2.52 Favored Glycine 0 CA--C 1.542 1.756 0 CA-C-O 122.754 1.197 . . . . 0.0 114.749 -177.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 13.8 t -103.58 141.33 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.123 0 O-C-N 118.09 -3.006 . . . . 0.0 107.704 83.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -113.4 133.91 54.92 Favored 'General case' 0 CA--C 1.553 1.058 0 N-CA-C 116.691 2.108 . . . . 0.0 116.691 -171.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -85.3 6.1 27.71 Favored 'General case' 0 CA--C 1.595 2.694 0 CA-C-N 115.04 -0.982 . . . . 0.0 113.482 169.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.85 102.95 0.79 Allowed 'General case' 0 CA--C 1.57 1.745 0 C-N-CA 127.563 2.345 . . . . 0.0 107.104 -171.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 95.6 m -67.56 131.95 92.92 Favored Pre-proline 0 CA--C 1.581 2.161 0 O-C-N 118.827 -2.42 . . . . 0.0 113.216 175.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -48.95 152.1 4.99 Favored 'Trans proline' 0 CA--C 1.569 2.227 0 C-N-CA 122.949 2.433 . . . . 0.0 116.68 175.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 1.8 t -74.25 150.68 40.14 Favored 'General case' 0 CA--C 1.572 1.826 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -173.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -67.76 162.38 24.0 Favored 'General case' 0 CA--C 1.574 1.886 0 N-CA-C 115.872 1.804 . . . . 0.0 115.872 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -64.25 119.05 9.54 Favored 'General case' 0 CA--C 1.572 1.808 0 O-C-N 120.735 -1.228 . . . . 0.0 111.754 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.91 -32.2 6.72 Favored Glycine 0 N--CA 1.494 2.56 0 CA-C-N 114.687 -1.142 . . . . 0.0 115.738 -172.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.6 mp -99.4 143.19 29.94 Favored 'General case' 0 CA--C 1.563 1.473 0 CA-C-O 122.798 1.285 . . . . 0.0 111.251 176.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.7 150.13 21.53 Favored 'General case' 0 CA--C 1.561 1.37 0 CA-C-O 122.449 1.118 . . . . 0.0 111.428 179.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 7.7 t -97.06 114.84 26.52 Favored 'General case' 0 CA--C 1.567 1.606 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.579 173.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -95.93 98.88 10.74 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.476 -1.39 . . . . 0.0 109.835 177.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -74.76 57.19 2.6 Favored Glycine 0 N--CA 1.498 2.815 0 N-CA-C 120.42 2.928 . . . . 0.0 120.42 -174.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.78 81.97 1.65 Allowed 'General case' 0 CA--C 1.572 1.817 0 C-N-CA 123.849 0.859 . . . . 0.0 111.043 175.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 71.7 tttt 64.69 -31.49 0.13 Allowed 'General case' 0 N--CA 1.509 2.488 0 N-CA-C 119.619 3.192 . . . . 0.0 119.619 175.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 27.6 p 70.91 43.72 0.66 Allowed 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 126.367 1.867 . . . . 0.0 115.783 -174.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 54.72 78.22 0.18 Allowed 'General case' 0 N--CA 1.503 2.222 0 C-N-CA 124.74 1.216 . . . . 0.0 112.733 -177.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . 0.339 0.9 OUTLIER 53.39 -1.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.504 0 N-CA-C 120.182 3.401 . . . . 0.0 120.182 -174.949 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.49 80.16 0.85 Allowed Glycine 0 N--CA 1.488 2.146 0 CA-C-N 120.572 1.533 . . . . 0.0 115.874 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.9 t -64.99 -9.92 25.44 Favored 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 119.176 3.028 . . . . 0.0 119.176 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.4 mp -121.69 -67.74 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.576 1.969 0 N-CA-C 104.75 -2.315 . . . . 0.0 104.75 173.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 36.7 p -129.77 168.21 16.89 Favored 'General case' 0 CA--C 1.573 1.846 0 C-N-CA 124.765 1.226 . . . . 0.0 108.734 171.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -132.82 94.92 3.47 Favored 'General case' 0 CA--C 1.563 1.473 0 O-C-N 120.142 -1.599 . . . . 0.0 111.915 -173.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 72.8 p -122.42 -94.22 0.5 Allowed 'General case' 0 N--CA 1.501 2.111 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 173.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -143.29 80.79 1.69 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.462 -1.399 . . . . 0.0 108.367 173.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -101.9 -178.6 3.76 Favored 'General case' 0 CA--C 1.572 1.812 0 CA-C-O 121.772 0.796 . . . . 0.0 111.866 -176.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -141.84 -174.79 14.8 Favored Glycine 0 N--CA 1.493 2.466 0 O-C-N 119.778 -1.826 . . . . 0.0 116.822 176.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.6 mm -126.49 142.95 41.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 CA-C-O 122.101 0.953 . . . . 0.0 110.081 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 8.0 m -73.83 127.77 33.73 Favored 'General case' 0 CA--C 1.569 1.71 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 173.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 72.3 m-70 -140.52 155.86 46.5 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.824 -1.172 . . . . 0.0 109.623 174.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -92.41 81.14 4.89 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 119.528 -1.982 . . . . 0.0 113.064 -173.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 72.5 t -115.34 -41.6 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 CA-C-N 112.685 -2.052 . . . . 0.0 112.865 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -66.01 -40.24 95.14 Favored Glycine 0 N--CA 1.497 2.714 0 N-CA-C 120.116 2.806 . . . . 0.0 120.116 -178.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 30.5 ttm105 70.41 -57.96 0.56 Allowed 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.494 1.728 0 CA-C-O 124.181 1.943 . . . . 0.0 115.102 -176.412 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 CA--C 1.579 2.069 0 CA-C-O 118.644 -0.693 . . . . 0.0 110.259 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -79.79 88.61 1.41 Allowed 'Trans proline' 0 CA--C 1.571 2.353 0 C-N-CA 122.434 2.089 . . . . 0.0 113.917 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -105.67 113.28 64.2 Favored Pre-proline 0 CA--C 1.576 1.962 0 CA-C-O 118.04 -0.981 . . . . 0.0 112.106 -175.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -68.19 19.97 0.13 Allowed 'Trans proline' 0 CA--C 1.582 2.898 0 N-CA-C 120.171 3.104 . . . . 0.0 120.171 174.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 27.1 ttt180 -141.5 117.27 10.4 Favored 'General case' 0 CA--C 1.564 1.5 0 C-N-CA 124.919 1.287 . . . . 0.0 107.778 178.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.07 -107.58 0.47 Allowed Glycine 0 N--CA 1.488 2.123 0 O-C-N 121.668 -0.645 . . . . 0.0 113.8 174.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 45.9 mm -93.54 -53.84 7.98 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 C-N-CA 122.738 0.415 . . . . 0.0 112.01 -175.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.2 pt -82.38 72.23 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 CA-C-N 119.811 1.187 . . . . 0.0 113.406 -174.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.25 32.3 pt -118.86 -139.2 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.577 1.991 0 C-N-CA 123.709 0.804 . . . . 0.0 108.968 175.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 58.46 62.39 1.98 Allowed 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 116.135 1.902 . . . . 0.0 116.135 176.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 36.7 tp -115.15 123.5 49.09 Favored 'General case' 0 CA--C 1.576 1.964 0 O-C-N 120.578 -1.327 . . . . 0.0 111.649 -177.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -66.1 162.81 18.83 Favored 'General case' 0 CA--C 1.576 1.976 0 O-C-N 119.757 -1.84 . . . . 0.0 115.624 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.31 130.38 44.24 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-O 121.928 0.87 . . . . 0.0 111.123 174.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 116.74 -13.8 14.8 Favored Glycine 0 CA--C 1.557 2.711 0 N-CA-C 116.844 1.498 . . . . 0.0 116.844 -172.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -103.98 151.15 23.54 Favored 'General case' 0 CA--C 1.567 1.627 0 CA-C-N 119.123 1.461 . . . . 0.0 112.716 -176.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.0 tt -73.33 123.43 23.76 Favored 'General case' 0 CA--C 1.574 1.888 0 O-C-N 121.308 -0.87 . . . . 0.0 112.095 -178.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.4 p -123.57 155.13 38.22 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 -176.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 mp -89.22 -76.67 0.4 Allowed 'General case' 0 CA--C 1.568 1.666 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 174.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -95.68 170.06 9.59 Favored 'General case' 0 CA--C 1.576 1.965 0 N-CA-C 114.414 1.264 . . . . 0.0 114.414 173.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 66.8 m -76.87 -21.58 54.74 Favored 'General case' 0 N--CA 1.507 2.381 0 N-CA-C 117.244 2.313 . . . . 0.0 117.244 176.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.79 7.26 3.23 Favored 'General case' 0 CA--C 1.583 2.229 0 N-CA-C 116.813 2.153 . . . . 0.0 116.813 174.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -96.2 -24.88 16.04 Favored 'General case' 0 CA--C 1.57 1.716 0 N-CA-C 115.662 1.727 . . . . 0.0 115.662 176.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 18.6 m -78.27 171.69 14.69 Favored 'General case' 0 CA--C 1.58 2.131 0 CA-C-N 121.029 1.74 . . . . 0.0 114.161 177.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -68.41 -65.37 0.71 Allowed 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.516 -1.365 . . . . 0.0 108.234 172.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 57.7 m -83.28 109.36 17.19 Favored 'General case' 0 CA--C 1.565 1.537 0 N-CA-C 101.157 -3.645 . . . . 0.0 101.157 168.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -67.66 82.36 0.18 Allowed 'General case' 0 N--CA 1.503 2.201 0 CA-C-O 125.158 2.409 . . . . 0.0 114.833 -171.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.8 t -145.25 77.39 1.52 Allowed 'General case' 0 CA--C 1.562 1.415 0 CA-C-N 111.549 -2.569 . . . . 0.0 112.482 -172.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.9 t -79.38 117.41 20.34 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 103.862 -2.644 . . . . 0.0 103.862 171.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.39 111.18 23.49 Favored 'General case' 0 CA--C 1.566 1.588 0 CA-C-O 123.256 1.503 . . . . 0.0 114.726 -169.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -85.56 172.1 11.21 Favored 'General case' 0 CA--C 1.572 1.803 0 C-N-CA 126.514 1.926 . . . . 0.0 111.82 174.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -76.1 -62.91 1.44 Allowed 'General case' 0 CA--C 1.588 2.407 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 169.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.6 p -147.26 -92.45 0.09 Allowed 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 102.329 -3.211 . . . . 0.0 102.329 172.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 92.3 mt -119.07 -12.13 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.567 0 CA-C-N 121.661 2.028 . . . . 0.0 113.318 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.9 tp -127.3 94.71 4.07 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 122.652 2.478 . . . . 0.0 112.214 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.7 p -172.43 164.7 5.71 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 124.473 1.109 . . . . 0.0 112.949 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 15.6 tp -75.56 121.45 22.42 Favored 'General case' 0 CA--C 1.574 1.892 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 171.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.4 m -95.69 138.89 32.71 Favored 'General case' 0 CA--C 1.569 1.693 0 O-C-N 121.246 -0.909 . . . . 0.0 113.304 -172.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 18.5 ttp180 -132.64 144.07 50.09 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.377 -0.827 . . . . 0.0 111.831 -175.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 71.6 m -63.76 138.4 58.47 Favored 'General case' 0 CA--C 1.566 1.574 0 O-C-N 119.676 -1.89 . . . . 0.0 113.302 175.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -138.88 -172.14 3.25 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-N 113.937 -1.483 . . . . 0.0 113.243 -173.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.5 mt -89.2 151.14 22.33 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-O 122.261 1.029 . . . . 0.0 112.74 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.15 152.66 36.64 Favored 'General case' 0 CA--C 1.572 1.825 0 O-C-N 121.619 -0.676 . . . . 0.0 112.525 173.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.93 171.14 15.51 Favored 'General case' 0 CA--C 1.573 1.833 0 CA-C-O 123.435 1.588 . . . . 0.0 114.186 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -118.83 164.97 14.62 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 122.897 1.332 . . . . 0.0 112.304 -174.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -61.24 137.77 58.23 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.299 -0.875 . . . . 0.0 113.209 178.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 64.58 26.37 13.27 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -173.096 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 52.4 m -123.01 149.62 44.09 Favored 'General case' 0 CA--C 1.561 1.378 0 CA-C-O 122.929 1.347 . . . . 0.0 110.186 174.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -75.63 102.13 5.22 Favored 'General case' 0 CA--C 1.576 1.945 0 CA-C-O 124.213 1.959 . . . . 0.0 114.131 -176.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.4 t -95.29 149.61 21.16 Favored 'General case' 0 CA--C 1.565 1.543 0 CA-C-O 124.066 1.889 . . . . 0.0 111.122 173.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.7 p -93.33 113.01 25.09 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 114.405 -1.27 . . . . 0.0 108.307 174.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.4 -8.32 59.02 Favored 'General case' 0 CA--C 1.563 1.462 0 N-CA-C 117.426 2.38 . . . . 0.0 117.426 -175.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . 0.334 0.2 OUTLIER -94.65 176.12 6.4 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 117.383 2.364 . . . . 0.0 117.383 -174.513 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.4 m 79.04 -147.08 0.02 OUTLIER 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 100.793 -3.78 . . . . 0.0 100.793 -167.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.596 2.8 mm? -177.98 -77.0 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.025 0 O-C-N 116.991 -3.568 . . . . 0.0 110.583 162.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -77.87 -20.31 53.25 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.91 -1.119 . . . . 0.0 112.607 171.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -90.0 -152.42 26.87 Favored Glycine 0 CA--C 1.55 2.242 0 CA-C-O 123.338 1.521 . . . . 0.0 112.507 172.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.0 t -84.62 139.41 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 CA-C-O 123.026 1.394 . . . . 0.0 114.038 -165.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -105.65 156.16 18.54 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -174.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -90.91 -68.07 0.81 Allowed 'General case' 0 N--CA 1.503 2.215 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 -175.042 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -116.91 96.03 5.28 Favored 'General case' 0 CA--C 1.567 1.616 0 N-CA-C 101.747 -3.427 . . . . 0.0 101.747 170.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 66.9 m -39.03 149.86 0.23 Allowed Pre-proline 0 CA--C 1.578 2.03 0 N-CA-C 120.547 3.536 . . . . 0.0 120.547 -173.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -65.63 170.9 10.41 Favored 'Trans proline' 0 CA--C 1.568 2.197 0 C-N-CA 122.223 1.949 . . . . 0.0 114.552 174.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 95.3 m -88.76 178.37 6.48 Favored 'General case' 0 CA--C 1.571 1.758 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 -174.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -61.55 174.53 0.75 Allowed 'General case' 0 CA--C 1.579 2.092 0 N-CA-C 117.494 2.405 . . . . 0.0 117.494 -174.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 24.6 tpt180 -61.02 111.63 1.76 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.124 -1.61 . . . . 0.0 113.136 -175.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 96.79 -19.74 53.49 Favored Glycine 0 N--CA 1.499 2.88 0 N-CA-C 116.892 1.517 . . . . 0.0 116.892 -172.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.94 120.35 38.17 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 124.804 1.242 . . . . 0.0 108.603 176.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.81 164.31 12.62 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 115.532 1.679 . . . . 0.0 115.532 -172.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 14.4 t -91.8 104.41 16.86 Favored 'General case' 0 CA--C 1.566 1.559 0 CA-C-N 113.306 -1.77 . . . . 0.0 107.32 171.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -91.78 99.2 12.12 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-N 121.525 1.966 . . . . 0.0 107.533 -177.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -72.32 64.87 1.34 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 117.283 1.673 . . . . 0.0 117.283 -175.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -53.33 -48.95 68.05 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 124.903 1.281 . . . . 0.0 114.423 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 46.6 tttt -111.93 0.73 16.18 Favored 'General case' 0 CA--C 1.587 2.395 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 172.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.0 m -85.03 60.86 6.51 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 119.728 -1.857 . . . . 0.0 112.47 174.096 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.3 tt -160.1 -58.37 0.06 Allowed 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 124.6 1.16 . . . . 0.0 109.323 -174.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 10.7 p -76.59 77.19 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.578 2.044 0 CA-C-O 123.377 1.56 . . . . 0.0 112.121 175.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -155.81 -59.61 0.01 OUTLIER Glycine 0 N--CA 1.493 2.439 0 N-CA-C 116.641 1.416 . . . . 0.0 116.641 -176.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 63.2 m 59.64 24.57 13.41 Favored 'General case' 0 N--CA 1.509 2.475 0 N-CA-C 118.548 2.795 . . . . 0.0 118.548 178.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.309 9.7 tp -145.46 -103.16 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 120.28 -1.513 . . . . 0.0 107.404 175.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 9.6 p -101.41 128.11 47.75 Favored 'General case' 0 N--CA 1.498 1.965 0 CA-C-N 120.887 1.676 . . . . 0.0 109.631 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -87.45 79.52 8.37 Favored 'General case' 0 CA--C 1.568 1.661 0 CA-C-O 122.768 1.271 . . . . 0.0 113.344 -174.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 24.6 p -96.52 -19.36 19.16 Favored 'General case' 0 N--CA 1.51 2.539 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 173.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -77.1 106.01 8.54 Favored 'General case' 0 CA--C 1.57 1.716 0 C-N-CA 124.608 1.163 . . . . 0.0 108.35 173.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -98.66 168.63 10.03 Favored 'General case' 0 CA--C 1.574 1.876 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -172.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -126.92 171.7 18.53 Favored Glycine 0 N--CA 1.494 2.507 0 O-C-N 120.915 -1.116 . . . . 0.0 114.397 175.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.6 mm -96.96 139.99 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.246 0 O-C-N 119.883 -1.951 . . . . 0.0 112.118 -168.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 3.8 m -74.3 131.92 41.61 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.249 -1.532 . . . . 0.0 114.39 173.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 64.7 m-70 -140.59 158.62 43.72 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 122.531 1.158 . . . . 0.0 110.98 177.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -95.94 130.21 42.98 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 120.964 -1.085 . . . . 0.0 111.623 -176.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.6 p -143.83 -50.02 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.886 0 N-CA-C 114.719 1.377 . . . . 0.0 114.719 -173.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -102.21 63.51 0.48 Allowed Glycine 0 N--CA 1.496 2.678 0 O-C-N 120.796 -1.19 . . . . 0.0 115.895 178.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 22.4 tpp85 -101.04 106.38 17.66 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-N 117.616 0.708 . . . . 0.0 112.004 -174.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.5 t . . . . . 0 N--CA 1.501 2.102 0 N-CA-C 116.604 2.075 . . . . 0.0 116.604 175.453 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 28.3 m . . . . . 0 CA--C 1.584 2.263 0 CA-C-O 114.524 -2.655 . . . . 0.0 116.903 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -81.36 77.52 3.94 Favored 'Trans proline' 0 CA--C 1.571 2.37 0 CA-C-N 127.713 3.79 . . . . 0.0 115.108 -174.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.6 t70 53.62 66.91 4.06 Favored Pre-proline 0 CA--C 1.591 2.555 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -78.03 159.4 30.53 Favored 'Trans proline' 0 CA--C 1.57 2.301 0 C-N-CA 122.531 2.154 . . . . 0.0 114.597 174.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.4 tpt180 -82.19 69.65 8.96 Favored 'General case' 0 N--CA 1.5 2.042 0 CA-C-O 123.542 1.639 . . . . 0.0 112.88 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.35 44.22 0.16 Allowed Glycine 0 N--CA 1.492 2.402 0 CA-C-N 114.419 -1.264 . . . . 0.0 115.256 177.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 10.3 tp -87.4 75.02 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.57 1.743 0 CA-C-O 122.818 1.294 . . . . 0.0 110.709 -175.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.255 24.0 mm 78.42 -52.17 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.612 0 C-N-CA 125.073 1.349 . . . . 0.0 111.364 -174.232 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 29.9 pt -98.79 175.96 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.579 2.095 0 CA-C-N 119.307 0.958 . . . . 0.0 111.432 175.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 84.73 82.51 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 126.65 1.98 . . . . 0.0 111.028 -174.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.73 139.9 51.99 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 123.363 1.554 . . . . 0.0 114.61 -176.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.5 156.88 30.71 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 122.241 1.02 . . . . 0.0 113.138 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -80.9 119.7 23.78 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 122.716 1.246 . . . . 0.0 109.02 -175.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 129.64 -20.61 5.16 Favored Glycine 0 CA--C 1.558 2.769 0 CA-C-N 114.222 -1.354 . . . . 0.0 114.692 -171.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.284 6.0 tp10 -99.62 158.85 15.47 Favored 'General case' 0 CA--C 1.572 1.802 0 CA-C-N 119.436 1.618 . . . . 0.0 112.036 -178.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.8 tp -75.37 135.44 40.81 Favored 'General case' 0 CA--C 1.578 2.028 0 O-C-N 120.963 -1.085 . . . . 0.0 113.714 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.9 p -133.85 159.74 39.75 Favored 'General case' 0 CA--C 1.564 1.514 0 C-N-CA 124.871 1.268 . . . . 0.0 112.361 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.7 mt -92.48 -77.14 0.44 Allowed 'General case' 0 CA--C 1.566 1.59 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 173.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.3 p30 -91.24 167.38 12.36 Favored 'General case' 0 CA--C 1.58 2.117 0 N-CA-C 115.43 1.641 . . . . 0.0 115.43 174.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.2 m -70.51 -20.79 62.81 Favored 'General case' 0 N--CA 1.509 2.52 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 174.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.96 4.45 5.37 Favored 'General case' 0 CA--C 1.579 2.088 0 N-CA-C 116.909 2.188 . . . . 0.0 116.909 174.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -94.83 -31.48 13.7 Favored 'General case' 0 CA--C 1.565 1.522 0 C-N-CA 125.082 1.353 . . . . 0.0 114.371 174.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 11.2 m -78.17 157.59 29.34 Favored 'General case' 0 CA--C 1.574 1.881 0 CA-C-N 121.703 2.047 . . . . 0.0 114.18 177.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -61.97 -57.07 13.1 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.753 -1.217 . . . . 0.0 109.506 172.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.7 m -83.82 110.6 18.48 Favored 'General case' 0 CA--C 1.567 1.597 0 N-CA-C 102.737 -3.06 . . . . 0.0 102.737 169.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -66.27 82.47 0.09 Allowed 'General case' 0 N--CA 1.502 2.141 0 CA-C-O 124.187 1.946 . . . . 0.0 114.153 -172.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.6 t -154.03 82.75 1.14 Allowed 'General case' 0 CA--C 1.567 1.611 0 CA-C-N 112.843 -1.98 . . . . 0.0 112.956 -173.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.9 t -85.6 111.86 20.44 Favored 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 104.231 -2.507 . . . . 0.0 104.231 171.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.15 123.06 43.16 Favored 'General case' 0 CA--C 1.561 1.388 0 CA-C-O 122.443 1.116 . . . . 0.0 112.841 -171.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -79.82 129.5 34.53 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.111 0.964 . . . . 0.0 112.404 -173.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -76.41 43.57 0.31 Allowed 'General case' 0 CA--C 1.583 2.218 0 N-CA-C 116.414 2.005 . . . . 0.0 116.414 174.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 43.7 p 61.03 88.28 0.09 Allowed 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 125.769 1.628 . . . . 0.0 114.306 174.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 23.6 mm 75.11 -57.19 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.613 0 C-N-CA 125.138 1.375 . . . . 0.0 113.264 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -42.67 -44.98 4.52 Favored 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 118.361 2.726 . . . . 0.0 118.361 -177.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.338 28.6 p 96.47 -4.91 0.07 Allowed 'General case' 0 N--CA 1.507 2.408 0 N-CA-C 118.81 2.893 . . . . 0.0 118.81 173.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 mp -74.61 95.35 2.8 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 121.926 2.148 . . . . 0.0 106.609 172.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.8 m -97.64 134.07 41.33 Favored 'General case' 0 CA--C 1.559 1.317 0 CA-C-N 114.661 -1.154 . . . . 0.0 113.67 -170.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 68.3 ttp85 -114.24 144.57 43.0 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.224 1.01 . . . . 0.0 111.687 -176.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 75.1 m -69.4 132.5 46.46 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 119.92 -1.737 . . . . 0.0 111.096 173.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.27 178.92 7.08 Favored 'General case' 0 CA--C 1.568 1.643 0 N-CA-C 115.151 1.537 . . . . 0.0 115.151 -173.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.82 160.29 18.81 Favored 'General case' 0 CA--C 1.573 1.842 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 178.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.59 156.63 25.08 Favored 'General case' 0 CA--C 1.582 2.173 0 CA-C-O 121.923 0.868 . . . . 0.0 112.533 175.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.01 166.21 21.79 Favored 'General case' 0 CA--C 1.572 1.819 0 N-CA-C 116.588 2.07 . . . . 0.0 116.588 -175.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 13.4 mtp-105 -131.33 171.39 13.41 Favored 'General case' 0 CA--C 1.564 1.519 0 CA-C-N 113.961 -1.472 . . . . 0.0 111.555 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -45.98 129.79 9.71 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 116.682 2.105 . . . . 0.0 116.682 -174.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 73.04 10.1 5.31 Favored 'General case' 0 N--CA 1.505 2.298 0 N-CA-C 115.623 1.712 . . . . 0.0 115.623 -174.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.0 t -107.92 159.49 16.49 Favored 'General case' 0 CA--C 1.567 1.607 0 CA-C-O 122.969 1.366 . . . . 0.0 111.286 174.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -71.39 128.4 35.73 Favored 'General case' 0 CA--C 1.563 1.466 0 CA-C-O 123.164 1.459 . . . . 0.0 114.006 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -122.37 128.53 51.09 Favored 'General case' 0 CA--C 1.561 1.387 0 CA-C-N 113.304 -1.771 . . . . 0.0 108.974 173.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.3 t -86.7 97.49 10.61 Favored 'General case' 0 CA--C 1.558 1.253 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.555 173.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.52 76.63 5.02 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 123.616 1.674 . . . . 0.0 112.159 -176.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -144.67 153.74 42.06 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 117.419 2.378 . . . . 0.0 117.419 -171.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.1 p -149.25 135.96 19.54 Favored 'General case' 0 CA--C 1.558 1.267 0 CA-C-O 124.265 1.983 . . . . 0.0 106.3 169.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.287 1.9 pp -141.35 -80.11 0.25 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 112.982 -1.917 . . . . 0.0 105.917 -176.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -150.84 -1.42 0.37 Allowed 'General case' 0 CA--C 1.591 2.522 0 C-N-CA 126.409 1.883 . . . . 0.0 110.759 172.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 170.97 -83.71 0.08 OUTLIER Glycine 0 C--N 1.351 1.391 0 O-C-N 119.046 -2.284 . . . . 0.0 117.686 -173.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 2.4 t -78.39 137.05 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 CA-C-N 119.758 1.779 . . . . 0.0 113.035 -157.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -123.96 130.5 52.69 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.109 -1.405 . . . . 0.0 110.458 -173.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -62.54 -43.73 98.09 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -178.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.6 mptt -139.33 106.87 5.57 Favored 'General case' 0 CA--C 1.562 1.434 0 N-CA-C 103.519 -2.771 . . . . 0.0 103.519 173.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.0 m -49.65 147.78 5.82 Favored Pre-proline 0 CA--C 1.591 2.525 0 N-CA-C 117.058 2.244 . . . . 0.0 117.058 -174.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -60.75 172.35 2.92 Favored 'Trans proline' 0 CA--C 1.569 2.231 0 C-N-CA 122.877 2.385 . . . . 0.0 118.003 -173.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 35.3 m -73.0 161.69 30.39 Favored 'General case' 0 CA--C 1.573 1.833 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -174.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -62.53 156.73 22.2 Favored 'General case' 0 CA--C 1.577 2.007 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -61.73 109.45 1.22 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.745 -1.222 . . . . 0.0 113.495 -174.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.86 -24.82 18.35 Favored Glycine 0 N--CA 1.5 2.923 0 N-CA-C 116.502 1.361 . . . . 0.0 116.502 -172.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 tt -98.28 136.7 38.09 Favored 'General case' 0 CA--C 1.574 1.877 0 C-N-CA 124.897 1.279 . . . . 0.0 109.034 176.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.89 159.01 15.2 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 116.855 2.169 . . . . 0.0 116.855 -172.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 9.1 t -95.55 132.43 40.68 Favored 'General case' 0 CA--C 1.573 1.849 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.329 171.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.298 2.8 pp20? -95.0 -158.91 0.68 Allowed 'General case' 0 N--CA 1.506 2.339 0 CA-C-N 122.096 2.226 . . . . 0.0 112.169 177.032 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -132.57 83.54 0.3 Allowed Glycine 0 N--CA 1.492 2.416 0 O-C-N 119.372 -2.08 . . . . 0.0 117.612 -173.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 47.0 m-20 -87.16 96.61 10.37 Favored 'General case' 0 CA--C 1.567 1.634 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 168.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -71.35 132.28 44.62 Favored 'General case' 0 CA--C 1.571 1.786 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 -174.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.1 t -72.07 -51.51 21.29 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 174.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.6 tt 69.93 -66.22 0.28 Allowed 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 125.947 1.699 . . . . 0.0 114.883 173.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.2 p -79.03 -47.59 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 N-CA-C 115.528 1.677 . . . . 0.0 115.528 -176.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.5 95.43 1.2 Allowed Glycine 0 N--CA 1.488 2.102 0 N-CA-C 116.329 1.292 . . . . 0.0 116.329 178.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 97.6 p -77.69 84.1 4.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.539 -0.977 . . . . 0.0 109.119 165.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.428 0.2 OUTLIER 64.19 -50.91 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.537 0 C-N-CA 126.406 1.882 . . . . 0.0 113.471 -171.632 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.255 54.4 m -121.43 172.96 7.68 Favored 'General case' 0 CA--C 1.582 2.208 0 C-N-CA 126.276 1.831 . . . . 0.0 109.333 173.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -78.98 74.73 5.5 Favored 'General case' 0 CA--C 1.579 2.06 0 O-C-N 119.631 -1.918 . . . . 0.0 110.527 174.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 56.4 p -110.03 72.94 0.81 Allowed 'General case' 0 N--CA 1.502 2.142 0 CA-C-O 125.005 2.336 . . . . 0.0 114.527 -173.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -161.88 115.92 1.89 Allowed 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 111.058 -2.792 . . . . 0.0 104.148 172.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -130.97 163.92 26.48 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 122.097 0.951 . . . . 0.0 112.822 -173.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.42 162.17 41.12 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 118.608 2.203 . . . . 0.0 118.608 175.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 19.6 mm -98.43 148.3 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.003 0 CA-C-O 122.587 1.184 . . . . 0.0 109.459 176.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.8 m -72.66 125.3 27.15 Favored 'General case' 0 CA--C 1.571 1.765 0 O-C-N 120.397 -1.439 . . . . 0.0 113.153 173.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 70.7 m-70 -140.51 152.29 45.46 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 120.245 -1.534 . . . . 0.0 111.573 176.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -96.94 122.57 40.06 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-O 122.102 0.953 . . . . 0.0 109.674 177.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 46.0 t -82.92 -34.77 11.72 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -174.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -166.29 -82.92 0.05 OUTLIER Glycine 0 N--CA 1.488 2.116 0 O-C-N 121.079 -1.013 . . . . 0.0 113.518 175.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 31.5 tpt180 -135.78 -73.9 0.45 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 117.138 0.469 . . . . 0.0 111.066 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.8 m . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 124.44 2.067 . . . . 0.0 113.44 -175.137 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 31.1 m . . . . . 0 CA--C 1.584 2.262 0 CA-C-O 114.374 -2.726 . . . . 0.0 116.504 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -70.5 77.79 1.31 Allowed 'Trans proline' 0 CA--C 1.575 2.543 0 CA-C-N 127.37 3.668 . . . . 0.0 117.302 -177.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . 0.267 18.1 t70 -92.63 -64.63 0.14 Allowed Pre-proline 0 CA--C 1.581 2.152 0 CA-C-O 115.922 -1.989 . . . . 0.0 111.17 176.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -76.51 97.7 1.15 Allowed 'Trans proline' 0 CA--C 1.571 2.337 0 CA-C-N 125.382 2.958 . . . . 0.0 111.21 173.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.7 mmm180 -85.26 69.29 10.72 Favored 'General case' 0 CA--C 1.572 1.798 0 N-CA-C 115.185 1.55 . . . . 0.0 115.185 -173.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -171.95 -101.19 0.14 Allowed Glycine 0 N--CA 1.483 1.806 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 174.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . 0.266 11.0 tp -137.86 -64.27 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.578 2.04 0 C-N-CA 124.254 1.022 . . . . 0.0 110.066 175.085 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.258 18.0 tt -134.46 -67.43 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 N-CA-C 102.728 -3.064 . . . . 0.0 102.728 172.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.259 29.5 pt -108.76 -146.8 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.586 2.359 0 N-CA-C 106.116 -1.809 . . . . 0.0 106.116 170.221 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 57.97 80.08 0.18 Allowed 'General case' 0 CA--C 1.582 2.204 0 N-CA-C 116.374 1.99 . . . . 0.0 116.374 176.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -149.68 146.05 27.04 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 123.34 1.543 . . . . 0.0 113.249 173.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -84.82 171.64 12.09 Favored 'General case' 0 CA--C 1.569 1.709 0 N-CA-C 114.071 1.138 . . . . 0.0 114.071 -178.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.21 127.51 31.62 Favored 'General case' 0 CA--C 1.575 1.906 0 O-C-N 121.14 -0.975 . . . . 0.0 111.466 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 117.41 -20.74 11.06 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 117.061 1.584 . . . . 0.0 117.061 -173.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -101.87 153.44 19.84 Favored 'General case' 0 CA--C 1.575 1.912 0 CA-C-N 119.064 1.432 . . . . 0.0 112.319 -179.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 tt -74.55 129.66 38.16 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.075 -1.016 . . . . 0.0 113.464 -174.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.6 p -127.02 151.24 48.86 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 124.272 1.029 . . . . 0.0 112.955 178.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.8 mp -87.79 -71.78 0.56 Allowed 'General case' 0 CA--C 1.57 1.719 0 O-C-N 120.946 -1.096 . . . . 0.0 108.46 173.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -95.25 173.48 7.53 Favored 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 120.531 1.514 . . . . 0.0 114.563 173.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.3 m -77.98 -19.1 55.11 Favored 'General case' 0 N--CA 1.505 2.282 0 N-CA-C 117.204 2.298 . . . . 0.0 117.204 176.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.91 10.69 2.64 Favored 'General case' 0 CA--C 1.58 2.131 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 172.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -94.41 -46.66 6.92 Favored 'General case' 0 CA--C 1.558 1.287 0 CA-C-O 117.67 -1.157 . . . . 0.0 113.071 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.9 m -65.87 149.24 50.51 Favored 'General case' 0 CA--C 1.576 1.959 0 CA-C-N 122.076 2.216 . . . . 0.0 113.685 178.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.0 mmmp? -59.37 -53.61 56.17 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 120.621 -1.3 . . . . 0.0 110.536 172.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 87.6 p -82.96 100.0 10.15 Favored 'General case' 0 CA--C 1.572 1.817 0 N-CA-C 102.179 -3.267 . . . . 0.0 102.179 167.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 51.6 m-80 -67.64 85.46 0.19 Allowed 'General case' 0 N--CA 1.501 2.12 0 CA-C-O 125.238 2.447 . . . . 0.0 114.611 -170.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 t -152.31 77.77 1.2 Allowed 'General case' 0 CA--C 1.562 1.424 0 CA-C-N 111.216 -2.72 . . . . 0.0 110.725 -173.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.3 t -82.1 111.16 17.98 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 172.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.52 130.28 46.57 Favored 'General case' 0 CA--C 1.556 1.193 0 CA-C-O 122.145 0.974 . . . . 0.0 111.338 -172.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -79.42 173.34 12.68 Favored 'General case' 0 CA--C 1.568 1.638 0 N-CA-C 114.894 1.442 . . . . 0.0 114.894 -173.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 44.6 p-10 -80.46 -63.98 1.29 Allowed 'General case' 0 CA--C 1.568 1.673 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 173.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.5 m -160.8 -83.76 0.04 OUTLIER 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 104.479 -2.415 . . . . 0.0 104.479 171.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 69.4 mt -123.53 -22.45 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.302 0 CA-C-N 120.116 1.325 . . . . 0.0 112.805 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.9 tp -76.89 -113.94 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 122.467 2.394 . . . . 0.0 111.642 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 95.3 p -161.05 101.67 1.26 Allowed 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 122.733 2.515 . . . . 0.0 115.571 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.8 tp -163.79 86.36 0.49 Allowed 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 103.821 -2.659 . . . . 0.0 103.821 172.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 11.8 m -105.77 129.56 53.94 Favored 'General case' 0 CA--C 1.566 1.576 0 CA-C-O 122.532 1.158 . . . . 0.0 112.712 -172.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 19.2 ttp180 -132.49 146.59 52.05 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.368 1.067 . . . . 0.0 110.655 -175.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 73.2 m -67.98 142.32 56.0 Favored 'General case' 0 CA--C 1.563 1.475 0 O-C-N 119.821 -1.799 . . . . 0.0 113.598 176.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.83 -173.81 3.81 Favored 'General case' 0 CA--C 1.569 1.693 0 CA-C-N 114.202 -1.363 . . . . 0.0 113.664 -174.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.9 mt -92.29 154.37 18.64 Favored 'General case' 0 CA--C 1.57 1.736 0 CA-C-O 122.47 1.128 . . . . 0.0 112.732 176.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.85 150.63 34.16 Favored 'General case' 0 CA--C 1.575 1.909 0 C-N-CA 123.648 0.779 . . . . 0.0 112.387 173.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.67 158.63 29.62 Favored 'General case' 0 CA--C 1.568 1.653 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 -173.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -115.23 168.59 9.82 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 113.464 -1.698 . . . . 0.0 111.414 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -53.55 130.16 35.02 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -174.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 72.05 27.91 2.6 Favored 'General case' 0 N--CA 1.506 2.338 0 C-N-CA 124.875 1.27 . . . . 0.0 114.101 -173.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.8 m -125.08 150.03 47.23 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.658 -1.277 . . . . 0.0 110.345 174.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -71.68 131.19 42.81 Favored 'General case' 0 CA--C 1.57 1.74 0 CA-C-O 122.941 1.353 . . . . 0.0 112.452 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.416 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 25.0 p -134.14 160.74 36.89 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-N 113.74 -1.573 . . . . 0.0 114.995 -174.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.1 m -79.38 101.94 8.41 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.892 0.854 . . . . 0.0 109.672 176.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -76.86 -47.56 20.93 Favored 'General case' 0 CA--C 1.571 1.783 0 N-CA-C 115.751 1.76 . . . . 0.0 115.751 -174.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -102.7 104.84 15.2 Favored 'General case' 0 CA--C 1.568 1.635 0 C-N-CA 124.599 1.16 . . . . 0.0 108.057 174.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.3 p -98.55 134.29 41.72 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 123.559 1.647 . . . . 0.0 113.799 -174.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -98.58 -170.83 2.01 Favored 'General case' 0 CA--C 1.578 2.031 0 CA-C-N 112.462 -2.153 . . . . 0.0 108.939 172.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -99.58 62.23 1.2 Allowed 'General case' 0 N--CA 1.501 2.119 0 CA-C-O 123.518 1.628 . . . . 0.0 108.38 174.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -169.49 -168.79 31.95 Favored Glycine 0 N--CA 1.475 1.275 0 CA-C-O 123.593 1.663 . . . . 0.0 114.149 -173.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.1 t -78.78 147.68 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 CA-C-O 123.215 1.483 . . . . 0.0 112.619 -163.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -117.09 138.34 51.69 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-N 114.313 -1.312 . . . . 0.0 113.396 -173.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -68.36 -33.16 73.77 Favored 'General case' 0 CA--C 1.589 2.479 0 O-C-N 121.256 -0.902 . . . . 0.0 112.697 172.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.56 109.65 3.72 Favored 'General case' 0 CA--C 1.566 1.59 0 N-CA-C 105.324 -2.102 . . . . 0.0 105.324 177.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 59.2 m -52.17 157.05 2.42 Favored Pre-proline 0 CA--C 1.591 2.551 0 N-CA-C 118.78 2.881 . . . . 0.0 118.78 -174.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -54.14 167.18 1.29 Allowed 'Trans proline' 0 CA--C 1.566 2.094 0 C-N-CA 123.374 2.716 . . . . 0.0 118.032 176.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.416 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 69.3 m -71.43 162.2 29.83 Favored 'General case' 0 CA--C 1.574 1.884 0 N-CA-C 115.028 1.492 . . . . 0.0 115.028 177.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -62.62 161.18 12.61 Favored 'General case' 0 CA--C 1.576 1.966 0 N-CA-C 115.624 1.712 . . . . 0.0 115.624 177.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 72.3 ttt180 -62.0 116.88 5.28 Favored 'General case' 0 CA--C 1.572 1.792 0 O-C-N 120.697 -1.252 . . . . 0.0 112.888 -175.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.29 -21.44 41.33 Favored Glycine 0 CA--C 1.559 2.842 0 N-CA-C 117.101 1.6 . . . . 0.0 117.101 -172.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 tp -99.78 141.27 32.8 Favored 'General case' 0 CA--C 1.572 1.814 0 C-N-CA 124.803 1.241 . . . . 0.0 111.545 -179.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -99.11 151.27 21.16 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.409 -1.432 . . . . 0.0 113.945 -174.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 13.1 t -95.41 99.12 11.08 Favored 'General case' 0 CA--C 1.57 1.715 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.49 172.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -97.17 116.6 29.67 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.483 -1.386 . . . . 0.0 110.38 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -140.37 153.58 23.58 Favored Glycine 0 N--CA 1.475 1.263 0 CA-C-O 124.756 2.309 . . . . 0.0 114.317 -174.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -122.0 -61.68 1.47 Allowed 'General case' 0 CA--C 1.567 1.613 0 CA-C-N 112.079 -2.061 . . . . 0.0 111.487 176.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -147.72 161.45 41.18 Favored 'General case' 0 CA--C 1.573 1.852 0 CA-C-N 120.045 1.293 . . . . 0.0 111.093 -174.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 85.4 p -85.97 -44.66 12.17 Favored 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 173.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -133.44 -73.94 0.49 Allowed 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 119.657 1.117 . . . . 0.0 110.571 -178.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . 0.3 14.9 p -109.56 -91.5 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 CA-C-N 119.358 0.981 . . . . 0.0 111.656 -176.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -152.61 77.98 0.21 Allowed Glycine 0 N--CA 1.491 2.308 0 O-C-N 121.062 -1.024 . . . . 0.0 114.149 -177.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.1 m -158.96 139.26 12.27 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 124.082 0.953 . . . . 0.0 109.721 175.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 11.8 pt -74.74 -93.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.728 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 26.8 p 62.45 -171.75 0.16 Allowed 'General case' 0 N--CA 1.509 2.497 0 CA-C-N 122.259 2.3 . . . . 0.0 113.538 174.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -64.7 -16.69 63.25 Favored 'General case' 0 CA--C 1.59 2.502 0 O-C-N 120.207 -1.558 . . . . 0.0 114.897 171.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 6.7 t -114.06 84.14 1.99 Allowed 'General case' 0 CA--C 1.567 1.599 0 CA-C-O 125.316 2.484 . . . . 0.0 111.355 177.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -134.3 93.24 3.04 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 111.74 -2.482 . . . . 0.0 105.536 174.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.0 m-30 -99.39 164.53 12.07 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 116.216 1.932 . . . . 0.0 116.216 -170.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -146.17 174.55 26.04 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 115.902 1.121 . . . . 0.0 115.902 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.8 mm -111.39 143.27 21.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 CA-C-O 122.17 0.986 . . . . 0.0 109.865 -177.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 69.4 m -71.04 120.61 16.85 Favored 'General case' 0 CA--C 1.569 1.701 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 174.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 71.8 m-70 -142.02 161.07 38.91 Favored 'General case' 0 CA--C 1.565 1.55 0 CA-C-O 123.349 1.547 . . . . 0.0 111.751 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -97.66 102.36 14.1 Favored 'General case' 0 CA--C 1.563 1.466 0 O-C-N 120.932 -1.105 . . . . 0.0 110.732 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 41.4 t -125.25 73.48 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 CA-C-O 122.354 1.074 . . . . 0.0 108.635 -175.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -88.79 29.79 5.7 Favored Glycine 0 N--CA 1.5 2.944 0 N-CA-C 119.494 2.558 . . . . 0.0 119.494 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -159.94 -69.4 0.07 Allowed 'General case' 0 N--CA 1.496 1.834 0 CA-C-N 118.974 1.387 . . . . 0.0 109.316 175.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 32.9 t . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 124.74 2.209 . . . . 0.0 110.625 -177.601 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 13.9 p . . . . . 0 CA--C 1.581 2.137 0 CA-C-O 118.976 -0.535 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -68.94 86.86 0.46 Allowed 'Trans proline' 0 CA--C 1.572 2.397 0 C-N-CA 122.698 2.266 . . . . 0.0 115.635 177.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -104.11 106.68 54.43 Favored Pre-proline 0 CA--C 1.578 2.033 0 CA-C-O 118.079 -0.962 . . . . 0.0 111.541 -176.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -79.09 84.38 2.06 Favored 'Trans proline' 0 CA--C 1.571 2.344 0 C-N-CA 122.388 2.059 . . . . 0.0 112.967 175.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.4 ppt_? -68.47 -9.63 50.04 Favored 'General case' 0 CA--C 1.577 2.007 0 N-CA-C 119.613 3.19 . . . . 0.0 119.613 -174.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.64 78.01 0.08 OUTLIER Glycine 0 N--CA 1.488 2.11 0 CA-C-N 120.525 1.511 . . . . 0.0 114.077 178.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . 0.289 46.2 mm 63.29 -71.09 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 C-N-CA 126.477 1.911 . . . . 0.0 113.868 176.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.5 mt 71.39 127.02 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 C-N-CA 125.424 1.489 . . . . 0.0 110.601 -178.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.8 pt -97.49 164.01 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 120.407 -1.433 . . . . 0.0 112.047 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 86.88 75.97 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.123 0 C-N-CA 126.795 2.038 . . . . 0.0 110.499 -174.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -125.83 149.85 48.31 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 123.402 1.572 . . . . 0.0 113.799 -177.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -79.5 165.05 23.42 Favored 'General case' 0 CA--C 1.573 1.832 0 O-C-N 120.944 -1.097 . . . . 0.0 112.358 174.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.21 132.64 44.37 Favored 'General case' 0 CA--C 1.574 1.868 0 O-C-N 120.611 -1.306 . . . . 0.0 111.348 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 116.28 13.89 8.0 Favored Glycine 0 CA--C 1.558 2.776 0 N-CA-C 115.705 1.042 . . . . 0.0 115.705 -172.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -129.49 152.3 49.17 Favored 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 119.187 1.493 . . . . 0.0 110.433 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 54.3 mt -72.28 125.94 28.58 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.095 -1.003 . . . . 0.0 113.304 -177.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.8 p -121.29 143.51 49.13 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 124.164 0.985 . . . . 0.0 112.271 -177.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.5 mt -78.77 -72.13 0.4 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.035 -1.04 . . . . 0.0 109.279 174.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 60.7 m-20 -99.03 -165.59 1.25 Allowed 'General case' 0 CA--C 1.578 2.046 0 CA-C-N 119.229 0.922 . . . . 0.0 112.551 172.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.1 t -82.8 -24.68 33.29 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 119.784 -1.822 . . . . 0.0 114.964 172.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.24 62.66 6.06 Favored 'General case' 0 CA--C 1.574 1.867 0 CA-C-O 125.057 2.36 . . . . 0.0 111.672 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -137.68 -59.49 0.67 Allowed 'General case' 0 CA--C 1.566 1.558 0 CA-C-N 111.531 -2.577 . . . . 0.0 109.929 -174.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 71.9 m -83.29 155.03 23.82 Favored 'General case' 0 CA--C 1.57 1.734 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 175.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.6 mtpt -60.75 -53.51 56.51 Favored 'General case' 0 N--CA 1.502 2.147 0 C-N-CA 124.089 0.956 . . . . 0.0 109.877 171.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 92.2 p -81.88 101.84 10.48 Favored 'General case' 0 CA--C 1.569 1.689 0 N-CA-C 105.353 -2.091 . . . . 0.0 105.353 170.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -72.7 76.72 1.11 Allowed 'General case' 0 N--CA 1.501 2.121 0 CA-C-O 124.973 2.32 . . . . 0.0 113.418 -173.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 t -139.94 70.54 1.36 Allowed 'General case' 0 CA--C 1.562 1.427 0 CA-C-N 111.99 -2.368 . . . . 0.0 108.28 -178.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.2 t -78.0 108.75 11.5 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 173.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.18 120.16 39.46 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-O 122.861 1.315 . . . . 0.0 112.856 -171.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -82.18 153.6 25.89 Favored 'General case' 0 CA--C 1.563 1.48 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -174.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -76.8 8.2 3.94 Favored 'General case' 0 CA--C 1.586 2.352 0 N-CA-C 116.402 2.001 . . . . 0.0 116.402 172.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.277 44.3 p 75.81 97.07 0.07 Allowed 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 127.063 2.145 . . . . 0.0 111.681 -178.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.28 4.2 mp 75.27 -46.94 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 C-N-CA 125.565 1.546 . . . . 0.0 114.305 174.41 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.0 mp -77.83 -126.85 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.158 0 CA-C-N 121.565 1.984 . . . . 0.0 112.249 -174.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.1 p -156.84 94.6 1.45 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 122.924 2.602 . . . . 0.0 116.119 178.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 tt -161.28 92.75 0.92 Allowed 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 103.724 -2.695 . . . . 0.0 103.724 173.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.5 m -110.32 116.11 30.88 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.312 -0.868 . . . . 0.0 112.222 -173.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -124.12 137.55 54.54 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 124.242 1.017 . . . . 0.0 109.782 -178.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 98.5 m -68.58 142.39 55.19 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 119.989 -1.694 . . . . 0.0 113.46 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -135.35 -176.75 4.37 Favored 'General case' 0 CA--C 1.565 1.555 0 CA-C-N 113.558 -1.656 . . . . 0.0 113.183 -173.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.6 pp -82.29 161.9 22.47 Favored 'General case' 0 CA--C 1.572 1.799 0 CA-C-O 122.429 1.109 . . . . 0.0 112.807 174.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -77.97 152.99 32.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.213 -0.929 . . . . 0.0 112.713 175.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.62 159.0 30.65 Favored 'General case' 0 CA--C 1.569 1.697 0 CA-C-O 123.972 1.844 . . . . 0.0 115.278 -174.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 56.8 mtt85 -126.53 168.13 14.69 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-N 113.475 -1.693 . . . . 0.0 110.939 -177.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -44.51 135.21 4.87 Favored 'General case' 0 CA--C 1.574 1.884 0 N-CA-C 116.953 2.205 . . . . 0.0 116.953 -173.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.39 6.6 p30 67.88 14.04 9.32 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 116.957 2.206 . . . . 0.0 116.957 -173.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.5 t -117.41 146.29 43.54 Favored 'General case' 0 CA--C 1.565 1.546 0 CA-C-O 122.867 1.318 . . . . 0.0 110.56 173.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -60.11 139.68 57.35 Favored 'General case' 0 CA--C 1.571 1.753 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 28.5 p -141.88 150.74 41.93 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 113.289 -1.778 . . . . 0.0 114.692 -174.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.8 t -79.83 109.67 14.47 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 173.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.03 -43.46 64.95 Favored 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -105.23 144.71 31.64 Favored 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 170.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 22.3 p -126.79 139.03 53.41 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.196 -1.565 . . . . 0.0 112.295 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -98.39 -169.24 1.77 Allowed 'General case' 0 CA--C 1.576 1.965 0 CA-C-N 113.098 -1.864 . . . . 0.0 109.513 173.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -103.22 62.53 0.79 Allowed 'General case' 0 N--CA 1.499 2.016 0 CA-C-O 123.258 1.504 . . . . 0.0 108.017 174.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -162.61 177.4 38.74 Favored Glycine 0 N--CA 1.475 1.272 0 CA-C-N 113.554 -1.657 . . . . 0.0 112.012 -174.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.4 t -78.34 141.06 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 CA-C-O 123.396 1.569 . . . . 0.0 111.764 -167.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -107.54 136.53 47.16 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 114.165 -1.38 . . . . 0.0 112.964 -172.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -68.41 -19.94 64.63 Favored 'General case' 0 CA--C 1.592 2.572 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 172.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.67 111.97 1.21 Allowed 'General case' 0 CA--C 1.575 1.925 0 C-N-CA 128.038 2.535 . . . . 0.0 104.837 -175.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 40.2 m -58.64 155.49 29.34 Favored Pre-proline 0 CA--C 1.588 2.442 0 O-C-N 118.946 -2.346 . . . . 0.0 116.75 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -64.2 168.59 12.24 Favored 'Trans proline' 0 CA--C 1.573 2.434 0 C-N-CA 122.691 2.26 . . . . 0.0 115.678 175.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 60.9 m -73.94 150.26 40.91 Favored 'General case' 0 CA--C 1.575 1.94 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -177.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.71 -175.96 1.84 Allowed 'General case' 0 CA--C 1.583 2.23 0 N-CA-C 116.97 2.211 . . . . 0.0 116.97 -174.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.46 114.38 1.99 Allowed 'General case' 0 CA--C 1.572 1.826 0 O-C-N 120.474 -1.391 . . . . 0.0 114.306 -179.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 80.83 15.61 77.17 Favored Glycine 0 N--CA 1.493 2.489 0 N-CA-C 119.43 2.532 . . . . 0.0 119.43 -174.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 tt -132.75 132.46 42.31 Favored 'General case' 0 CA--C 1.568 1.641 0 CA-C-N 119.024 1.412 . . . . 0.0 108.267 -174.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.07 158.06 15.77 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -173.367 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 16.0 t -94.54 111.56 23.32 Favored 'General case' 0 CA--C 1.568 1.671 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.907 172.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -97.0 105.44 17.59 Favored 'General case' 0 CA--C 1.567 1.619 0 O-C-N 120.452 -1.405 . . . . 0.0 110.818 -175.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -71.78 76.65 0.68 Allowed Glycine 0 N--CA 1.495 2.569 0 N-CA-C 116.641 1.416 . . . . 0.0 116.641 -177.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -124.39 -37.33 2.54 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 115.777 1.769 . . . . 0.0 115.777 -176.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -92.11 82.1 5.05 Favored 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 122.029 2.195 . . . . 0.0 112.282 -177.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 53.6 p -102.31 65.81 0.97 Allowed 'General case' 0 CA--C 1.57 1.727 0 CA-C-O 122.663 1.221 . . . . 0.0 111.847 174.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 48.8 tp -91.23 90.49 7.79 Favored 'General case' 0 CA--C 1.564 1.511 0 C-N-CA 124.702 1.201 . . . . 0.0 109.17 174.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.1 p -53.79 -33.89 24.06 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.394 0 N-CA-C 118.307 2.706 . . . . 0.0 118.307 -174.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -85.68 74.23 2.46 Favored Glycine 0 N--CA 1.495 2.578 0 CA-C-N 119.381 0.991 . . . . 0.0 113.999 174.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.6 t -149.24 165.75 30.94 Favored 'General case' 0 CA--C 1.57 1.749 0 CA-C-O 122.045 0.926 . . . . 0.0 112.572 -170.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.3 pp -76.49 -77.07 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.146 0 O-C-N 120.801 -1.187 . . . . 0.0 112.002 177.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.251 14.5 t -134.63 43.66 2.73 Favored 'General case' 0 N--CA 1.517 2.889 0 CA-C-O 126.129 2.871 . . . . 0.0 117.113 175.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -145.51 68.99 1.22 Allowed 'General case' 0 CA--C 1.57 1.731 0 CA-C-N 109.866 -3.334 . . . . 0.0 102.376 170.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 16.0 p -99.76 -79.13 0.49 Allowed 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.859 0.864 . . . . 0.0 109.863 -170.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -124.45 66.98 1.07 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 120.336 -1.477 . . . . 0.0 109.173 173.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -134.0 179.77 6.05 Favored 'General case' 0 CA--C 1.574 1.902 0 CA-C-O 122.628 1.204 . . . . 0.0 112.82 -173.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -102.41 169.58 19.65 Favored Glycine 0 N--CA 1.489 2.213 0 O-C-N 120.705 -1.247 . . . . 0.0 115.373 174.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 35.5 mm -110.54 135.46 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 173.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 23.1 m -63.2 131.1 47.3 Favored 'General case' 0 CA--C 1.57 1.748 0 O-C-N 120.528 -1.357 . . . . 0.0 114.352 173.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 -144.6 148.27 34.15 Favored 'General case' 0 CA--C 1.563 1.48 0 O-C-N 120.731 -1.23 . . . . 0.0 109.718 173.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -96.87 130.18 44.2 Favored 'General case' 0 CA--C 1.565 1.55 0 O-C-N 120.692 -1.255 . . . . 0.0 109.835 176.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 61.8 t -93.53 -59.06 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.098 -174.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -145.63 61.97 0.47 Allowed Glycine 0 N--CA 1.494 2.512 0 O-C-N 121.528 -0.733 . . . . 0.0 114.672 174.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 31.4 ttm180 65.76 -75.15 0.05 Allowed 'General case' 0 N--CA 1.5 2.042 0 C-N-CA 125.376 1.471 . . . . 0.0 113.092 -175.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.0 t . . . . . 0 CA--C 1.565 1.532 0 CA-C-O 123.71 1.719 . . . . 0.0 113.247 176.933 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 CA--C 1.586 2.347 0 CA-C-O 114.472 -2.68 . . . . 0.0 116.571 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -77.21 82.65 2.31 Favored 'Trans proline' 0 CA--C 1.57 2.322 0 CA-C-N 127.829 3.832 . . . . 0.0 115.372 -175.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -91.6 129.51 42.44 Favored Pre-proline 0 CA--C 1.584 2.287 0 CA-C-O 117.188 -1.387 . . . . 0.0 111.458 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -44.75 -31.02 4.67 Favored 'Trans proline' 0 N--CA 1.503 2.062 1 N-CA-C 122.518 4.007 . . . . 0.0 122.518 -175.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -12.28 51.92 Favored 'General case' 0 CA--C 1.581 2.161 0 N-CA-C 117.407 2.373 . . . . 0.0 117.407 174.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 103.39 25.37 7.4 Favored Glycine 0 N--CA 1.497 2.731 0 N-CA-C 119.57 2.588 . . . . 0.0 119.57 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . 0.319 48.9 mt 65.86 -73.3 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.143 0 C-N-CA 126.571 1.949 . . . . 0.0 112.902 175.394 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 71.8 mt -134.2 102.0 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 5.7 pt -116.91 -129.05 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.196 0 O-C-N 121.764 -0.585 . . . . 0.0 111.056 -175.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 85.72 87.41 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 126.733 2.013 . . . . 0.0 114.327 174.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -138.08 155.07 49.14 Favored 'General case' 0 CA--C 1.574 1.873 0 CA-C-O 122.401 1.096 . . . . 0.0 110.074 172.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -78.11 164.09 25.3 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 119.376 -2.077 . . . . 0.0 114.732 -173.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -73.91 150.18 41.01 Favored 'General case' 0 CA--C 1.573 1.854 0 CA-C-O 122.239 1.019 . . . . 0.0 110.606 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.59 24.76 34.96 Favored Glycine 0 CA--C 1.562 3.027 0 O-C-N 121.484 -0.76 . . . . 0.0 114.819 -170.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -132.95 143.57 49.55 Favored 'General case' 0 CA--C 1.569 1.699 0 C-N-CA 125.632 1.573 . . . . 0.0 108.763 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 34.9 mt -70.92 134.19 47.04 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -174.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.7 p -140.48 152.68 45.81 Favored 'General case' 0 CA--C 1.561 1.373 0 C-N-CA 124.002 0.921 . . . . 0.0 113.124 -174.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -85.4 -77.88 0.28 Allowed 'General case' 0 CA--C 1.567 1.616 0 CA-C-O 117.743 -1.122 . . . . 0.0 108.222 172.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -96.35 170.75 9.02 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 121.149 1.795 . . . . 0.0 114.114 174.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.8 m -69.4 -10.69 59.07 Favored 'General case' 0 N--CA 1.508 2.451 0 N-CA-C 117.077 2.251 . . . . 0.0 117.077 174.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.41 52.82 2.56 Favored 'General case' 0 CA--C 1.571 1.764 0 CA-C-O 123.554 1.645 . . . . 0.0 114.939 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -141.32 -49.59 0.41 Allowed 'General case' 0 CA--C 1.574 1.878 0 CA-C-N 113.968 -1.469 . . . . 0.0 113.98 -177.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 67.4 m -84.19 160.92 20.73 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 116.15 1.907 . . . . 0.0 116.15 -174.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -60.53 -54.24 47.79 Favored 'General case' 0 N--CA 1.504 2.232 0 C-N-CA 124.754 1.222 . . . . 0.0 109.112 171.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.8 t -82.64 92.25 7.12 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 102.07 -3.307 . . . . 0.0 102.07 167.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -72.75 69.19 0.9 Allowed 'General case' 0 N--CA 1.497 1.922 0 CA-C-O 124.64 2.162 . . . . 0.0 116.435 -170.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 43.9 t -145.44 96.39 2.82 Favored 'General case' 0 CA--C 1.557 1.225 0 CA-C-N 112.643 -2.071 . . . . 0.0 110.155 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 15.6 t -78.08 115.08 17.55 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 103.802 -2.666 . . . . 0.0 103.802 171.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -98.84 123.7 43.26 Favored 'General case' 0 CA--C 1.566 1.56 0 CA-C-O 123.156 1.455 . . . . 0.0 114.538 -170.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -87.23 116.77 25.54 Favored 'General case' 0 CA--C 1.562 1.418 0 CA-C-N 114.026 -1.443 . . . . 0.0 113.603 -174.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -83.42 56.35 3.54 Favored 'General case' 0 CA--C 1.581 2.143 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 174.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 17.7 p 77.18 109.73 0.07 Allowed 'General case' 0 N--CA 1.505 2.308 0 N-CA-C 119.454 3.131 . . . . 0.0 119.454 171.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.302 4.7 mp 53.52 -87.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 C-N-CA 126.79 2.036 . . . . 0.0 115.766 172.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.7 tp -103.37 88.1 3.03 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 175.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 54.4 p -136.2 150.5 49.04 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 116.303 1.964 . . . . 0.0 116.303 -172.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 46.2 tp -80.37 117.09 20.81 Favored 'General case' 0 CA--C 1.569 1.709 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 173.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.9 m -92.6 137.2 32.57 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 122.964 1.364 . . . . 0.0 114.515 -171.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.8 ttt180 -134.53 137.35 43.76 Favored 'General case' 0 N--CA 1.495 1.8 0 C-N-CA 124.055 0.942 . . . . 0.0 110.181 -174.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 67.1 m -65.98 148.23 52.12 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 119.606 -1.934 . . . . 0.0 114.946 -177.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.67 -179.47 5.94 Favored 'General case' 0 CA--C 1.57 1.74 0 CA-C-N 113.488 -1.687 . . . . 0.0 112.83 -174.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.2 mt -81.65 138.91 35.24 Favored 'General case' 0 CA--C 1.566 1.579 0 O-C-N 121.069 -1.02 . . . . 0.0 112.932 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.9 pttt -70.67 134.5 47.58 Favored 'General case' 0 CA--C 1.573 1.852 0 O-C-N 121.606 -0.684 . . . . 0.0 110.3 173.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.41 154.73 38.66 Favored 'General case' 0 CA--C 1.561 1.389 0 N-CA-C 118.37 2.73 . . . . 0.0 118.37 -171.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -113.09 171.73 7.37 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 112.569 -2.105 . . . . 0.0 112.722 -177.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -58.94 125.01 21.79 Favored 'General case' 0 CA--C 1.568 1.669 0 CA-C-N 114.838 -1.073 . . . . 0.0 113.009 -174.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 85.51 18.22 0.12 Allowed 'General case' 0 CA--C 1.586 2.338 0 C-N-CA 125.956 1.702 . . . . 0.0 114.177 -173.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.3 t -119.77 151.79 38.24 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 119.953 -1.717 . . . . 0.0 112.312 175.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -74.51 120.71 20.44 Favored 'General case' 0 CA--C 1.575 1.918 0 CA-C-O 123.755 1.74 . . . . 0.0 112.534 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 87' ' ' CYS . 19.3 p -122.86 152.53 40.66 Favored 'General case' 0 CA--C 1.562 1.426 0 C-N-CA 127.146 2.178 . . . . 0.0 112.482 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 65.9 m -75.57 123.4 25.43 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.403 -1.436 . . . . 0.0 107.804 173.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.82 -49.33 25.73 Favored 'General case' 0 CA--C 1.565 1.525 0 N-CA-C 116.884 2.179 . . . . 0.0 116.884 -172.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -91.97 151.84 20.31 Favored 'General case' 0 CA--C 1.566 1.591 0 CA-C-N 118.758 0.708 . . . . 0.0 109.867 173.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.6 p -121.0 146.58 46.54 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 124.411 2.053 . . . . 0.0 110.588 174.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -98.47 -126.29 0.16 Allowed 'General case' 0 CA--C 1.569 1.711 0 CA-C-N 112.469 -2.15 . . . . 0.0 105.884 174.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -149.17 70.83 1.1 Allowed 'General case' 0 CA--C 1.564 1.511 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 169.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 175.47 -135.78 3.14 Favored Glycine 0 N--CA 1.483 1.819 0 CA-C-N 115.644 -0.707 . . . . 0.0 113.999 -176.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.4 t -79.76 144.22 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.175 0 CA-C-O 122.25 1.024 . . . . 0.0 112.196 -172.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -123.6 135.84 54.18 Favored 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 123.515 0.726 . . . . 0.0 112.56 -173.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -60.42 -51.08 71.02 Favored 'General case' 0 N--CA 1.503 2.218 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 177.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -135.41 122.02 20.79 Favored 'General case' 0 CA--C 1.559 1.311 0 N-CA-C 103.892 -2.633 . . . . 0.0 103.892 174.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 97.2 m -43.91 130.66 4.2 Favored Pre-proline 0 CA--C 1.592 2.588 0 N-CA-C 117.852 2.538 . . . . 0.0 117.852 -174.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -77.65 60.75 7.28 Favored 'Trans proline' 0 CA--C 1.576 2.614 0 C-N-CA 123.179 2.586 . . . . 0.0 118.637 -173.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 37.8 m 61.7 163.92 0.08 Allowed 'General case' 0 CA--C 1.582 2.198 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.42 174.07 11.83 Favored 'General case' 0 CA--C 1.575 1.94 0 N-CA-C 115.19 1.552 . . . . 0.0 115.19 178.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.99 108.65 1.26 Allowed 'General case' 0 CA--C 1.574 1.868 0 O-C-N 120.476 -1.39 . . . . 0.0 112.469 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 93.18 27.7 13.07 Favored Glycine 0 N--CA 1.497 2.709 0 N-CA-C 118.036 1.974 . . . . 0.0 118.036 -173.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 12.3 tp -140.9 138.42 33.87 Favored 'General case' 0 CA--C 1.567 1.614 0 CA-C-N 118.794 1.297 . . . . 0.0 110.225 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -98.74 154.1 18.23 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.708 -1.245 . . . . 0.0 112.828 -176.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.2 t -94.77 146.62 24.06 Favored 'General case' 0 CA--C 1.575 1.911 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.943 172.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -97.6 -115.17 0.14 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 120.381 -1.449 . . . . 0.0 110.378 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 179.49 100.98 0.14 Allowed Glycine 0 N--CA 1.492 2.398 0 CA-C-N 122.33 2.332 . . . . 0.0 116.199 -176.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -96.16 -84.4 0.35 Allowed 'General case' 0 CA--C 1.578 2.044 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 171.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.88 159.59 36.94 Favored 'General case' 0 CA--C 1.574 1.882 0 C-N-CA 125.33 1.452 . . . . 0.0 110.056 176.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 58.8 p -154.46 -80.71 0.09 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.079 -1.638 . . . . 0.0 111.436 174.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 74.94 76.2 0.11 Allowed 'General case' 0 CA--C 1.581 2.166 0 C-N-CA 125.883 1.673 . . . . 0.0 113.569 -178.476 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . 0.355 3.9 p 50.38 -62.12 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.287 0 N-CA-C 121.041 3.719 . . . . 0.0 121.041 174.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 164.34 -58.62 0.26 Allowed Glycine 0 N--CA 1.494 2.541 0 N-CA-C 116.905 1.522 . . . . 0.0 116.905 -176.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.6 t -75.05 -12.35 60.3 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 118.914 2.931 . . . . 0.0 118.914 -177.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 43.6 mm -109.57 -77.19 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.172 0 N-CA-C 106.884 -1.525 . . . . 0.0 106.884 174.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.253 43.7 p 68.16 146.6 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 117.766 2.506 . . . . 0.0 117.766 174.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -117.16 117.0 28.4 Favored 'General case' 0 CA--C 1.565 1.524 0 N-CA-C 101.939 -3.356 . . . . 0.0 101.939 172.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 41.1 p -90.41 69.04 6.9 Favored 'General case' 0 N--CA 1.503 2.184 0 CA-C-O 126.736 3.16 . . . . 0.0 115.079 -171.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -145.23 85.0 1.72 Allowed 'General case' 0 CA--C 1.564 1.513 0 CA-C-N 109.272 -3.604 . . . . 0.0 105.882 173.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -93.85 167.1 11.85 Favored 'General case' 0 CA--C 1.574 1.902 0 O-C-N 120.609 -1.307 . . . . 0.0 112.324 -174.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.22 162.33 23.85 Favored Glycine 0 N--CA 1.495 2.576 0 N-CA-C 119.116 2.406 . . . . 0.0 119.116 -174.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 23.2 mm -95.96 136.76 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 O-C-N 120.975 -1.309 . . . . 0.0 110.774 -171.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 53.2 m -67.85 124.22 22.72 Favored 'General case' 0 CA--C 1.569 1.691 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 174.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -144.12 159.79 42.04 Favored 'General case' 0 CA--C 1.565 1.525 0 CA-C-O 123.328 1.537 . . . . 0.0 111.642 174.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -99.44 132.64 44.63 Favored 'General case' 0 CA--C 1.564 1.512 0 O-C-N 120.855 -1.153 . . . . 0.0 110.7 175.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 59.9 t -106.83 5.64 9.99 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.43 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -179.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.15 -50.5 66.57 Favored Glycine 0 N--CA 1.497 2.765 0 O-C-N 119.132 -2.23 . . . . 0.0 118.358 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 52.6 ttp180 -86.03 81.96 8.28 Favored 'General case' 0 CA--C 1.572 1.798 0 CA-C-N 118.08 0.94 . . . . 0.0 110.346 173.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 94.6 p . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 123.329 1.537 . . . . 0.0 110.676 -175.778 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 14.0 m . . . . . 0 CA--C 1.578 2.044 0 CA-C-O 118.411 -0.804 . . . . 0.0 110.569 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -80.63 73.42 6.03 Favored 'Trans proline' 0 CA--C 1.572 2.389 0 CA-C-N 123.015 2.112 . . . . 0.0 114.67 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -101.9 114.97 65.39 Favored Pre-proline 0 CA--C 1.578 2.046 0 CA-C-O 118.103 -0.951 . . . . 0.0 111.297 -175.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -79.8 88.57 1.42 Allowed 'Trans proline' 0 CA--C 1.571 2.341 0 CA-C-N 123.051 2.125 . . . . 0.0 114.383 -178.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -78.23 -22.13 48.9 Favored 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -177.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 86.97 -56.48 4.63 Favored Glycine 0 N--CA 1.499 2.864 0 CA-C-N 121.54 1.973 . . . . 0.0 116.272 -174.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 63.9 mt -70.38 -47.25 67.21 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.174 0 C-N-CA 123.801 0.841 . . . . 0.0 111.76 170.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 62.8 mt -83.25 86.83 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 CA-C-N 120.052 1.296 . . . . 0.0 108.782 178.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.8 pt -121.88 -85.68 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 C-N-CA 123.976 0.91 . . . . 0.0 109.056 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 47.93 82.48 0.04 OUTLIER 'General case' 0 CA--C 1.58 2.128 0 N-CA-C 118.017 2.599 . . . . 0.0 118.017 174.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 mt -131.54 146.48 52.24 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 123.568 1.651 . . . . 0.0 113.838 175.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -80.51 162.6 24.27 Favored 'General case' 0 CA--C 1.567 1.616 0 CA-C-N 114.193 -1.367 . . . . 0.0 113.47 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -76.72 131.78 38.95 Favored 'General case' 0 CA--C 1.578 2.041 0 N-CA-C 107.788 -1.189 . . . . 0.0 107.788 173.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 101.66 26.7 7.48 Favored Glycine 0 CA--C 1.561 2.948 0 CA-C-N 115.766 -0.652 . . . . 0.0 114.469 -171.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -129.24 139.46 51.83 Favored 'General case' 0 CA--C 1.566 1.574 0 C-N-CA 125.121 1.368 . . . . 0.0 109.243 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.0 mp -68.08 124.96 24.86 Favored 'General case' 0 CA--C 1.574 1.868 0 O-C-N 121.152 -0.967 . . . . 0.0 112.191 -178.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 6.8 p -131.39 152.1 50.94 Favored 'General case' 0 CA--C 1.561 1.399 0 C-N-CA 124.229 1.011 . . . . 0.0 113.072 -174.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 97.7 mt -84.09 -74.97 0.36 Allowed 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 118.092 -0.956 . . . . 0.0 108.917 174.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -98.57 172.93 7.18 Favored 'General case' 0 N--CA 1.501 2.09 0 CA-C-N 120.998 1.726 . . . . 0.0 113.331 173.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.9 m -71.92 -9.67 58.68 Favored 'General case' 0 N--CA 1.508 2.463 0 N-CA-C 116.639 2.089 . . . . 0.0 116.639 173.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.72 4.2 12.18 Favored 'General case' 0 CA--C 1.572 1.816 0 N-CA-C 118.27 2.693 . . . . 0.0 118.27 176.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -97.77 -35.59 10.49 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 115.346 1.609 . . . . 0.0 115.346 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 71.4 m -81.05 155.77 26.17 Favored 'General case' 0 CA--C 1.564 1.498 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 177.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -62.96 -50.9 68.98 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.385 -0.822 . . . . 0.0 110.089 172.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.0 p -82.46 97.39 8.38 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 102.851 -3.018 . . . . 0.0 102.851 167.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -70.85 80.55 0.63 Allowed 'General case' 0 N--CA 1.498 1.94 0 CA-C-O 124.6 2.143 . . . . 0.0 115.354 -171.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 41.0 t -158.28 93.12 1.2 Allowed 'General case' 0 CA--C 1.557 1.218 0 CA-C-N 112.248 -2.251 . . . . 0.0 110.699 -176.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.8 t -80.22 113.98 18.79 Favored 'General case' 0 CA--C 1.56 1.348 0 N-CA-C 104.933 -2.247 . . . . 0.0 104.933 171.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 46.7 tp60 -91.99 115.79 28.37 Favored 'General case' 0 CA--C 1.558 1.287 0 CA-C-O 122.347 1.07 . . . . 0.0 113.884 -172.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 24.3 t-80 -81.1 117.28 21.54 Favored 'General case' 0 CA--C 1.562 1.432 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.734 176.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -72.15 56.83 0.34 Allowed 'General case' 0 CA--C 1.581 2.163 0 N-CA-C 116.923 2.194 . . . . 0.0 116.923 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 44.3 p 61.25 69.13 0.68 Allowed 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 126.037 1.735 . . . . 0.0 115.071 173.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.331 3.7 mp 71.1 -32.84 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.534 0 C-N-CA 125.191 1.396 . . . . 0.0 113.762 -179.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.1 tp -53.07 -20.95 4.06 Favored 'General case' 0 CA--C 1.586 2.364 0 N-CA-C 117.627 2.454 . . . . 0.0 117.627 174.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.288 26.3 p 77.93 1.44 2.83 Favored 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 121.692 3.96 . . . . 0.0 121.692 172.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.5 tp -73.64 96.25 2.45 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 121.711 2.05 . . . . 0.0 106.76 172.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.9 m -97.68 107.37 19.85 Favored 'General case' 0 CA--C 1.56 1.344 0 CA-C-O 123.139 1.447 . . . . 0.0 111.648 -171.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -131.22 132.83 44.93 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-N 114.546 -1.206 . . . . 0.0 108.98 -174.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 99.5 m -62.42 150.56 39.53 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 122.402 2.365 . . . . 0.0 116.504 -174.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -132.61 173.41 11.36 Favored 'General case' 0 CA--C 1.568 1.658 0 CA-C-N 114.162 -1.381 . . . . 0.0 113.842 -174.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 26.6 tp -85.47 146.19 27.07 Favored 'General case' 0 CA--C 1.569 1.677 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -174.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -69.95 143.32 52.7 Favored 'General case' 0 CA--C 1.577 2.001 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 175.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.93 169.61 17.96 Favored 'General case' 0 CA--C 1.579 2.077 0 N-CA-C 118.272 2.694 . . . . 0.0 118.272 -173.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 46.3 mtp180 -112.66 173.87 6.17 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 113.19 -1.823 . . . . 0.0 112.57 -178.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -64.2 136.76 57.51 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 122.083 0.944 . . . . 0.0 113.134 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 70.98 23.31 4.29 Favored 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 124.93 1.292 . . . . 0.0 114.118 -173.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.9 t -121.87 148.54 44.59 Favored 'General case' 0 CA--C 1.558 1.266 0 CA-C-O 122.596 1.189 . . . . 0.0 110.263 174.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -67.53 133.49 49.56 Favored 'General case' 0 CA--C 1.576 1.953 0 CA-C-O 123.749 1.738 . . . . 0.0 112.137 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 87' ' ' CYS . 22.3 p -137.41 156.43 48.2 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 112.855 -1.975 . . . . 0.0 112.552 -174.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 92.9 p -81.64 117.57 22.1 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 172.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.36 -55.31 7.3 Favored 'General case' 0 CA--C 1.583 2.244 0 CA-C-O 122.813 1.292 . . . . 0.0 108.181 172.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -155.24 127.64 7.82 Favored 'General case' 0 CA--C 1.573 1.838 0 N-CA-C 101.795 -3.409 . . . . 0.0 101.795 169.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.4 m -88.39 -70.43 0.64 Allowed 'General case' 0 CA--C 1.568 1.651 0 O-C-N 119.434 -2.042 . . . . 0.0 106.125 171.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -152.59 -72.67 0.14 Allowed 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 124.694 1.198 . . . . 0.0 109.816 173.284 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -162.43 -43.45 0.04 OUTLIER 'General case' 0 CA--C 1.579 2.084 0 C-N-CA 125.128 1.371 . . . . 0.0 113.851 -173.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -96.95 -120.44 3.94 Favored Glycine 0 N--CA 1.485 1.942 0 N-CA-C 116.94 1.536 . . . . 0.0 116.94 -172.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.1 t -82.16 141.04 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 CA-C-O 122.415 1.102 . . . . 0.0 111.11 -175.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 17.0 m-30 -122.65 148.84 44.79 Favored 'General case' 0 CA--C 1.559 1.317 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 -171.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -77.97 -9.05 58.91 Favored 'General case' 0 CA--C 1.585 2.311 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 173.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.61 140.04 9.45 Favored 'General case' 0 CA--C 1.571 1.752 0 C-N-CA 126.68 1.992 . . . . 0.0 106.686 -174.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 96.3 m -82.64 156.26 68.13 Favored Pre-proline 0 CA--C 1.581 2.135 0 N-CA-C 116.706 2.113 . . . . 0.0 116.706 177.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.51 171.52 16.96 Favored 'Trans proline' 0 CA--C 1.571 2.361 0 C-N-CA 122.704 2.269 . . . . 0.0 112.989 173.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 5.3 m -85.85 170.07 12.74 Favored 'General case' 0 CA--C 1.568 1.666 0 CA-C-O 123.751 1.739 . . . . 0.0 115.042 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -59.73 154.68 17.53 Favored 'General case' 0 CA--C 1.572 1.824 0 N-CA-C 115.805 1.78 . . . . 0.0 115.805 178.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -65.62 113.37 4.18 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 122.62 1.2 . . . . 0.0 112.427 -174.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 115.43 -27.08 8.66 Favored Glycine 0 N--CA 1.497 2.756 0 CA-C-N 114.099 -1.41 . . . . 0.0 116.355 -172.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 11.7 tp -97.42 138.81 34.29 Favored 'General case' 0 CA--C 1.569 1.688 0 CA-C-N 118.504 1.152 . . . . 0.0 110.936 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -97.19 148.82 22.69 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.424 -1.423 . . . . 0.0 113.443 -174.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 16.7 t -94.37 100.82 12.78 Favored 'General case' 0 CA--C 1.569 1.681 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.094 173.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -97.23 107.99 20.63 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 120.587 1.54 . . . . 0.0 111.66 -176.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 142.65 123.55 1.83 Allowed Glycine 0 N--CA 1.483 1.782 0 CA-C-O 122.244 0.913 . . . . 0.0 113.261 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -117.55 151.91 36.18 Favored 'General case' 0 CA--C 1.572 1.82 0 CA-C-O 122.315 1.055 . . . . 0.0 109.764 165.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . 0.301 11.5 tmtt? 68.91 -94.03 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 125.351 1.46 . . . . 0.0 109.302 -173.218 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.7 t 59.91 110.06 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 117.683 2.475 . . . . 0.0 117.683 173.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -63.45 -32.91 74.49 Favored 'General case' 0 CA--C 1.584 2.263 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 172.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 91.8 t -77.68 92.8 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.573 1.836 0 O-C-N 120.774 -1.204 . . . . 0.0 107.865 174.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -147.49 -115.33 0.85 Allowed Glycine 0 N--CA 1.483 1.816 0 CA-C-N 115.034 -0.984 . . . . 0.0 114.083 -178.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.4 t -142.52 -67.59 0.37 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 122.26 -0.553 . . . . 0.0 112.351 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 11.6 tt -149.35 136.5 13.33 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.484 0 CA-C-O 123.087 1.422 . . . . 0.0 107.96 176.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.252 0.7 OUTLIER 63.56 158.8 0.08 Allowed 'General case' 0 N--CA 1.502 2.136 0 CA-C-O 123.243 1.497 . . . . 0.0 114.482 -174.727 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -97.57 68.93 2.16 Favored 'General case' 0 CA--C 1.569 1.703 0 O-C-N 120.959 -1.088 . . . . 0.0 112.583 -176.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . 0.297 4.3 t -97.17 -93.42 0.22 Allowed 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 117.634 -1.174 . . . . 0.0 111.011 -175.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -151.45 87.74 1.39 Allowed 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 121.719 2.054 . . . . 0.0 111.678 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -108.82 154.53 21.95 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 123.079 1.418 . . . . 0.0 110.159 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -166.18 154.73 25.5 Favored Glycine 0 N--CA 1.488 2.165 0 O-C-N 121.075 -1.016 . . . . 0.0 112.936 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.7 mm -94.19 138.43 20.59 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.161 0 CA-C-N 119.44 1.62 . . . . 0.0 109.188 -176.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 61.2 m -74.73 123.41 24.88 Favored 'General case' 0 CA--C 1.563 1.461 0 N-CA-C 116.177 1.917 . . . . 0.0 116.177 178.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -141.11 158.62 43.66 Favored 'General case' 0 CA--C 1.561 1.373 0 CA-C-O 123.488 1.614 . . . . 0.0 111.483 179.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -98.15 40.7 1.16 Allowed 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 174.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.0 t 48.95 71.85 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 C-N-CA 127.012 2.125 . . . . 0.0 113.811 174.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -81.0 70.26 3.1 Favored Glycine 0 N--CA 1.493 2.488 0 N-CA-C 115.865 1.106 . . . . 0.0 115.865 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 29.9 mmm180 60.48 66.14 0.97 Allowed 'General case' 0 N--CA 1.501 2.111 0 C-N-CA 124.994 1.318 . . . . 0.0 113.738 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 38.5 t . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 123.963 1.839 . . . . 0.0 114.645 -174.865 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 13.1 m . . . . . 0 CA--C 1.581 2.164 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.63 -35.21 6.25 Favored 'Trans proline' 0 CA--C 1.57 2.319 0 N-CA-C 117.741 2.169 . . . . 0.0 117.741 -178.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -116.36 99.78 52.98 Favored Pre-proline 0 CA--C 1.579 2.075 0 CA-C-N 119.355 0.98 . . . . 0.0 109.763 176.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -63.76 128.78 22.97 Favored 'Trans proline' 0 CA--C 1.567 2.162 0 C-N-CA 122.642 2.228 . . . . 0.0 115.502 176.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -77.74 34.11 0.18 Allowed 'General case' 0 CA--C 1.579 2.082 0 N-CA-C 118.542 2.793 . . . . 0.0 118.542 -174.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 53.19 40.82 60.35 Favored Glycine 0 N--CA 1.5 2.967 0 N-CA-C 120.196 2.838 . . . . 0.0 120.196 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . 0.332 1.1 tt 46.95 14.94 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.586 2.347 0 N-CA-C 120.705 3.594 . . . . 0.0 120.705 -177.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.25 21.8 pt 39.72 78.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.512 2.65 0 C-N-CA 125.896 1.678 . . . . 0.0 115.476 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.0 pt -91.46 136.94 23.0 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 CA-C-O 123.512 1.625 . . . . 0.0 112.138 -173.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 55.7 m-80 -146.63 70.85 1.22 Allowed 'General case' 0 CA--C 1.573 1.853 0 CA-C-N 113.811 -1.54 . . . . 0.0 113.792 -174.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mp -131.0 136.44 48.51 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.21 -1.557 . . . . 0.0 112.226 174.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -84.97 172.41 11.35 Favored 'General case' 0 CA--C 1.572 1.814 0 O-C-N 121.365 -0.835 . . . . 0.0 112.887 174.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -77.01 114.54 15.92 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 173.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 135.25 -8.97 4.41 Favored Glycine 0 CA--C 1.56 2.883 0 CA-C-N 114.298 -1.319 . . . . 0.0 115.627 -172.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -114.76 154.65 28.14 Favored 'General case' 0 CA--C 1.569 1.675 0 CA-C-N 120.084 1.942 . . . . 0.0 112.162 -177.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -81.83 147.95 29.1 Favored 'General case' 0 CA--C 1.574 1.866 0 CA-C-O 122.114 0.959 . . . . 0.0 113.303 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.6 p -137.55 -179.03 5.5 Favored 'General case' 0 CA--C 1.575 1.906 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -174.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.6 tp -99.29 -74.14 0.6 Allowed 'General case' 0 CA--C 1.58 2.121 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 171.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -94.87 -173.15 2.9 Favored 'General case' 0 N--CA 1.501 2.12 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 174.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.8 m -78.05 -31.93 50.59 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 119.79 -1.819 . . . . 0.0 114.703 172.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.83 65.43 4.99 Favored 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 124.706 2.193 . . . . 0.0 111.608 173.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -139.96 -50.17 0.48 Allowed 'General case' 0 CA--C 1.566 1.584 0 CA-C-N 111.89 -2.414 . . . . 0.0 111.258 -174.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 95.4 m -81.27 140.8 34.64 Favored 'General case' 0 CA--C 1.564 1.518 0 O-C-N 121.162 -0.961 . . . . 0.0 109.997 173.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -53.35 -30.3 38.69 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 118.694 2.85 . . . . 0.0 118.694 -173.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -79.78 -76.68 0.21 Allowed 'General case' 0 CA--C 1.574 1.879 0 CA-C-N 118.219 0.463 . . . . 0.0 110.516 173.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -173.07 -39.67 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.35 0 N-CA-C 116.565 2.061 . . . . 0.0 116.565 -176.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.3 t -97.71 110.52 23.07 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 119.711 3.226 . . . . 0.0 119.711 -169.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 22.5 t -95.41 118.87 32.93 Favored 'General case' 0 CA--C 1.562 1.409 0 N-CA-C 104.436 -2.431 . . . . 0.0 104.436 168.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.99 114.28 27.45 Favored 'General case' 0 CA--C 1.57 1.731 0 CA-C-O 123.185 1.469 . . . . 0.0 114.672 -172.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -82.52 155.54 24.49 Favored 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 126.432 1.893 . . . . 0.0 112.348 177.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.2 p30 -81.88 40.15 0.59 Allowed 'General case' 0 CA--C 1.587 2.396 0 O-C-N 120.434 -1.416 . . . . 0.0 114.21 172.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 48.7 p 63.54 90.02 0.08 Allowed 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 126.429 1.892 . . . . 0.0 113.68 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.301 3.2 mp 69.31 -38.04 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 174.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.3 mt -71.09 -87.41 0.02 OUTLIER 'General case' 0 CA--C 1.576 1.956 0 CA-C-N 122.405 2.366 . . . . 0.0 112.228 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 91.9 p -155.67 -131.25 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.022 0 CA-C-N 122.029 2.195 . . . . 0.0 114.005 174.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 20.7 tp 43.76 75.83 0.09 Allowed 'General case' 0 N--CA 1.502 2.125 0 C-N-CA 125.911 1.684 . . . . 0.0 115.113 -174.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.7 m -98.81 86.61 3.55 Favored 'General case' 0 CA--C 1.565 1.531 0 CA-C-O 122.205 1.002 . . . . 0.0 110.69 -174.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -120.36 127.66 52.52 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.653 1.181 . . . . 0.0 109.977 -174.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 74.8 m -66.6 140.42 57.94 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 116.281 1.956 . . . . 0.0 116.281 -174.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -142.34 173.17 11.77 Favored 'General case' 0 CA--C 1.565 1.554 0 CA-C-N 113.312 -1.767 . . . . 0.0 114.314 -173.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.6 pp -84.9 165.52 17.6 Favored 'General case' 0 CA--C 1.573 1.831 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 178.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -74.35 146.69 42.84 Favored 'General case' 0 CA--C 1.574 1.877 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.41 164.04 25.84 Favored 'General case' 0 CA--C 1.571 1.761 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -174.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 65.3 mtt180 -128.87 165.28 21.34 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 122.556 1.17 . . . . 0.0 112.338 -175.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -43.09 126.77 4.08 Favored 'General case' 0 CA--C 1.568 1.656 0 N-CA-C 117.3 2.333 . . . . 0.0 117.3 -172.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 72.39 17.97 4.66 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 115.248 1.573 . . . . 0.0 115.248 -174.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.7 t -117.75 150.32 39.3 Favored 'General case' 0 CA--C 1.565 1.533 0 CA-C-O 122.758 1.266 . . . . 0.0 110.619 174.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -65.33 122.0 16.12 Favored 'General case' 0 CA--C 1.573 1.85 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 -175.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.6 t -113.03 137.34 51.56 Favored 'General case' 0 CA--C 1.558 1.275 0 CA-C-N 113.489 -1.687 . . . . 0.0 111.232 174.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.1 t -99.68 115.68 30.03 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 172.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.19 -22.33 45.11 Favored 'General case' 0 CA--C 1.572 1.789 0 N-CA-C 115.997 1.851 . . . . 0.0 115.997 -178.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -129.33 154.64 46.68 Favored 'General case' 0 CA--C 1.578 2.027 0 N-CA-C 117.431 2.382 . . . . 0.0 117.431 -176.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.6 t 131.47 -152.51 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.523 2 N-CA-C 97.042 -5.17 . . . . 0.0 97.042 -171.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.653 3.6 mt 176.02 -69.36 0.01 OUTLIER 'General case' 0 N--CA 1.521 3.075 1 O-C-N 113.353 -5.842 . . . . 0.0 110.608 160.858 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -78.8 -26.81 44.35 Favored 'General case' 0 CA--C 1.577 1.997 0 CA-C-N 112.433 -2.167 . . . . 0.0 108.883 168.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -81.97 159.76 40.05 Favored Glycine 0 CA--C 1.55 2.219 0 N-CA-C 107.619 -2.193 . . . . 0.0 107.619 170.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.6 t -70.87 135.67 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 CA-C-O 123.715 1.721 . . . . 0.0 112.028 -163.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 -66.7 124.23 22.3 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 113.014 -1.903 . . . . 0.0 114.779 -172.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -69.3 -40.63 77.57 Favored 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 114.787 1.402 . . . . 0.0 114.787 -174.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -149.95 103.84 3.24 Favored 'General case' 0 CA--C 1.569 1.684 0 N-CA-C 101.593 -3.484 . . . . 0.0 101.593 172.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 57.2 m -39.91 127.61 1.58 Allowed Pre-proline 0 CA--C 1.587 2.396 0 N-CA-C 116.913 2.19 . . . . 0.0 116.913 -173.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -47.83 166.33 0.12 Allowed 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 123.52 2.813 . . . . 0.0 119.266 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 58.4 m -68.01 146.09 53.86 Favored 'General case' 0 CA--C 1.569 1.686 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -178.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -178.72 1.42 Allowed 'General case' 0 CA--C 1.577 2.011 0 N-CA-C 115.268 1.581 . . . . 0.0 115.268 -176.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -60.84 112.45 2.05 Favored 'General case' 0 CA--C 1.571 1.76 0 O-C-N 120.349 -1.469 . . . . 0.0 113.096 -175.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.13 -20.65 35.17 Favored Glycine 0 N--CA 1.496 2.699 0 N-CA-C 118.629 2.212 . . . . 0.0 118.629 -173.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.1 mp -106.35 151.93 24.23 Favored 'General case' 0 CA--C 1.569 1.689 0 CA-C-N 118.841 1.32 . . . . 0.0 112.183 -178.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.96 158.26 17.87 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-O 122.368 1.08 . . . . 0.0 113.611 -176.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 6.1 t -90.71 120.04 31.43 Favored 'General case' 0 CA--C 1.57 1.745 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.526 173.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -96.34 -135.06 0.23 Allowed 'General case' 0 CA--C 1.582 2.193 0 CA-C-N 120.23 1.377 . . . . 0.0 111.775 -174.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -173.25 68.76 0.1 Allowed Glycine 0 N--CA 1.496 2.685 0 O-C-N 119.225 -2.172 . . . . 0.0 117.564 -175.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -108.32 27.8 8.97 Favored 'General case' 0 CA--C 1.581 2.166 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 171.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 59.0 mtmt 67.63 -43.89 0.47 Allowed 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 -174.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 70.2 m 62.41 50.35 3.75 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 116.805 2.15 . . . . 0.0 116.805 174.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 39.5 tp -76.4 -26.65 55.8 Favored 'General case' 0 CA--C 1.58 2.105 0 N-CA-C 115.186 1.551 . . . . 0.0 115.186 174.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.6 p -72.83 73.79 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.582 2.178 0 CA-C-O 123.965 1.84 . . . . 0.0 112.382 175.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 125.71 29.59 0.96 Allowed Glycine 0 CA--C 1.557 2.698 0 N-CA-C 116.723 1.449 . . . . 0.0 116.723 -174.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.2 t -151.45 144.01 24.26 Favored 'General case' 0 CA--C 1.566 1.595 0 CA-C-N 119.302 1.551 . . . . 0.0 110.661 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 5.3 tp -76.29 -64.03 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.271 0 O-C-N 121.008 -1.057 . . . . 0.0 111.193 174.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 75.8 p -89.89 166.03 13.75 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 123.39 1.567 . . . . 0.0 110.667 173.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -146.17 91.58 2.08 Favored 'General case' 0 CA--C 1.564 1.486 0 O-C-N 121.101 -0.999 . . . . 0.0 109.374 -174.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 73.5 p -99.51 -82.29 0.44 Allowed 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.64 -0.663 . . . . 0.0 109.945 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -144.28 82.59 1.7 Allowed 'General case' 0 CA--C 1.564 1.483 0 O-C-N 120.903 -1.123 . . . . 0.0 108.638 174.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -113.18 162.69 15.69 Favored 'General case' 0 CA--C 1.57 1.716 0 CA-C-O 123.094 1.426 . . . . 0.0 110.541 -178.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -139.39 -155.68 6.71 Favored Glycine 0 N--CA 1.48 1.575 0 O-C-N 120.909 -1.119 . . . . 0.0 114.555 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.9 mm -128.97 142.64 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 35.7 m -70.86 129.45 39.09 Favored 'General case' 0 CA--C 1.564 1.491 0 O-C-N 120.561 -1.337 . . . . 0.0 113.017 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 63.6 m-70 -140.46 155.81 46.57 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 123.203 1.478 . . . . 0.0 111.38 176.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -95.33 128.52 42.24 Favored 'General case' 0 CA--C 1.562 1.429 0 CA-C-O 122.367 1.079 . . . . 0.0 110.607 -176.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 9.9 m -103.37 40.42 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.579 2.072 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -174.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 82.13 -69.43 3.33 Favored Glycine 0 N--CA 1.493 2.434 0 O-C-N 120.274 -1.516 . . . . 0.0 116.468 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -86.92 81.35 8.15 Favored 'General case' 0 CA--C 1.572 1.804 0 CA-C-O 121.871 0.843 . . . . 0.0 111.874 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 33.1 t . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 124.804 2.24 . . . . 0.0 111.382 -179.366 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.256 8.8 p . . . . . 0 CA--C 1.585 2.321 0 CA-C-O 114.759 -2.543 . . . . 0.0 116.045 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -71.49 90.08 0.7 Allowed 'Trans proline' 0 CA--C 1.57 2.304 0 CA-C-N 127.315 3.648 . . . . 0.0 114.681 -179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.5 t70 62.8 87.82 0.13 Allowed Pre-proline 0 CA--C 1.586 2.364 0 C-N-CA 124.78 1.232 . . . . 0.0 113.437 -174.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -53.58 -27.05 39.6 Favored 'Trans proline' 0 CA--C 1.571 2.374 0 N-CA-C 120.744 3.325 . . . . 0.0 120.744 176.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 75.23 106.89 0.08 Allowed 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 125.667 1.587 . . . . 0.0 113.47 174.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -127.16 68.89 0.53 Allowed Glycine 0 N--CA 1.494 2.539 0 O-C-N 121.556 -0.715 . . . . 0.0 113.876 173.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 48.8 mm -111.44 80.37 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -178.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.413 2.6 pp 50.23 -100.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.343 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 -179.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.6 pt -115.23 177.17 2.0 Allowed 'Isoleucine or valine' 0 CA--C 1.576 1.965 0 CA-C-N 120.92 1.691 . . . . 0.0 112.623 -178.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.375 0.0 OUTLIER 80.81 80.91 0.04 OUTLIER 'General case' 0 CA--C 1.584 2.254 0 C-N-CA 126.54 1.936 . . . . 0.0 111.944 -177.758 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.86 158.97 38.74 Favored 'General case' 0 CA--C 1.573 1.858 0 CA-C-O 122.989 1.376 . . . . 0.0 111.786 173.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -80.47 165.33 22.28 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.097 -1.627 . . . . 0.0 114.456 -174.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.89 123.69 26.1 Favored 'General case' 0 CA--C 1.574 1.887 0 O-C-N 121.44 -0.787 . . . . 0.0 111.036 -179.217 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 129.0 2.37 5.62 Favored Glycine 0 CA--C 1.557 2.677 0 N-CA-C 117.371 1.708 . . . . 0.0 117.371 -173.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -121.71 155.49 35.1 Favored 'General case' 0 CA--C 1.572 1.801 0 CA-C-N 119.895 1.847 . . . . 0.0 112.0 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.4 tt -71.19 137.64 48.89 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -174.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -125.59 176.43 6.87 Favored 'General case' 0 CA--C 1.571 1.78 0 N-CA-C 115.459 1.651 . . . . 0.0 115.459 -174.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.4 mp -110.11 -75.85 0.62 Allowed 'General case' 0 CA--C 1.577 1.993 0 N-CA-C 104.463 -2.421 . . . . 0.0 104.463 169.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -96.19 -178.65 4.39 Favored 'General case' 0 CA--C 1.584 2.264 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 172.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.8 m -86.82 -19.49 28.91 Favored 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 116.617 2.081 . . . . 0.0 116.617 174.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.33 13.91 1.07 Allowed 'General case' 0 CA--C 1.578 2.051 0 N-CA-C 117.539 2.422 . . . . 0.0 117.539 174.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -95.22 -27.25 15.61 Favored 'General case' 0 CA--C 1.568 1.641 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.2 m -80.44 166.72 20.97 Favored 'General case' 0 CA--C 1.58 2.113 0 CA-C-N 120.875 1.671 . . . . 0.0 113.803 177.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.9 mtpp -67.65 -59.77 3.07 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.432 -1.417 . . . . 0.0 108.358 172.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.2 p -82.74 100.13 10.08 Favored 'General case' 0 CA--C 1.57 1.718 0 N-CA-C 102.891 -3.003 . . . . 0.0 102.891 168.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -68.5 79.72 0.27 Allowed 'General case' 0 N--CA 1.498 1.972 0 CA-C-O 125.232 2.444 . . . . 0.0 116.233 -171.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 t -146.23 95.88 2.69 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-N 111.646 -2.525 . . . . 0.0 110.188 -174.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.3 t -93.95 123.75 37.52 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 107.138 -1.431 . . . . 0.0 107.138 171.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.1 tp60 -76.35 149.16 37.04 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 122.784 1.278 . . . . 0.0 110.427 174.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.24 155.5 20.83 Favored 'General case' 0 CA--C 1.574 1.873 1 N-CA-C 129.105 6.706 . . . . 0.0 129.105 -170.664 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -100.71 -34.34 9.89 Favored 'General case' 0 CA--C 1.578 2.024 0 CA-C-N 110.215 -3.175 . . . . 0.0 119.367 173.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.19 -55.43 3.68 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.415 -1.428 . . . . 0.0 113.79 -172.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 9.2 pt -76.81 -52.68 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.265 0 CA-C-N 120.48 1.491 . . . . 0.0 110.893 173.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.3 tt -95.88 118.72 33.06 Favored 'General case' 0 CA--C 1.565 1.555 0 N-CA-C 103.544 -2.762 . . . . 0.0 103.544 171.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.4 p -91.21 61.74 4.58 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 118.726 2.861 . . . . 0.0 118.726 -172.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.7 tp -173.72 110.48 0.17 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 174.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.2 m -91.11 122.05 33.42 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 121.026 1.739 . . . . 0.0 111.72 -174.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -136.48 147.38 47.13 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-N 114.31 -1.314 . . . . 0.0 111.55 -172.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 89.4 m -65.49 135.58 55.34 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 118.278 -2.764 . . . . 0.0 111.357 174.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -134.02 -176.7 4.27 Favored 'General case' 0 CA--C 1.566 1.575 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -173.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -91.51 162.02 14.72 Favored 'General case' 0 CA--C 1.573 1.857 0 CA-C-O 122.524 1.155 . . . . 0.0 113.745 177.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -81.83 153.07 26.61 Favored 'General case' 0 CA--C 1.572 1.816 0 CA-C-O 121.529 0.681 . . . . 0.0 112.354 174.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.49 158.84 28.5 Favored 'General case' 0 CA--C 1.567 1.631 0 N-CA-C 115.332 1.604 . . . . 0.0 115.332 -176.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -118.21 174.2 6.36 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 114.383 -1.28 . . . . 0.0 111.897 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -48.96 133.96 17.48 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 116.795 2.146 . . . . 0.0 116.795 -172.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.9 m120 71.57 15.47 6.06 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 -174.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.1 t -113.7 152.61 30.23 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 120.778 -1.201 . . . . 0.0 111.766 174.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -64.72 136.9 57.44 Favored 'General case' 0 CA--C 1.568 1.64 0 CA-C-O 123.313 1.53 . . . . 0.0 112.777 174.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 24.6 p -136.26 143.25 44.16 Favored 'General case' 0 CA--C 1.562 1.409 0 CA-C-N 112.911 -1.95 . . . . 0.0 112.241 -177.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 72.5 m -77.83 99.53 5.97 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-O 122.098 0.952 . . . . 0.0 108.787 177.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -75.74 -47.14 27.24 Favored 'General case' 0 CA--C 1.567 1.626 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 -173.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -79.17 -40.27 31.3 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 176.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.2 p 58.96 164.18 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.091 0 CA-C-O 124.332 2.015 . . . . 0.0 114.367 -174.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.74 -166.53 1.73 Allowed 'General case' 0 CA--C 1.566 1.561 0 CA-C-O 123.466 1.603 . . . . 0.0 108.916 173.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -96.16 68.37 2.66 Favored 'General case' 0 CA--C 1.576 1.96 0 N-CA-C 104.962 -2.236 . . . . 0.0 104.962 171.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 178.0 -165.75 35.45 Favored Glycine 0 N--CA 1.484 1.887 0 N-CA-C 116.474 1.35 . . . . 0.0 116.474 -173.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 2.8 t -77.89 146.62 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 CA-C-O 122.257 1.027 . . . . 0.0 111.594 -171.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -110.34 137.01 48.64 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -172.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -61.44 -52.54 64.12 Favored 'General case' 0 CA--C 1.579 2.085 0 CA-C-N 114.075 -1.42 . . . . 0.0 111.846 173.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -140.71 109.08 5.83 Favored 'General case' 0 CA--C 1.566 1.578 0 N-CA-C 104.084 -2.562 . . . . 0.0 104.084 173.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 42.8 m -48.94 156.89 0.85 Allowed Pre-proline 0 CA--C 1.587 2.393 0 N-CA-C 118.027 2.602 . . . . 0.0 118.027 -177.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -60.25 170.84 3.64 Favored 'Trans proline' 0 CA--C 1.573 2.43 0 C-N-CA 122.678 2.252 . . . . 0.0 116.179 177.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 62.5 m -73.16 149.72 42.74 Favored 'General case' 0 CA--C 1.571 1.773 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -70.48 171.98 9.21 Favored 'General case' 0 CA--C 1.577 2.003 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 -58.94 112.95 1.85 Allowed 'General case' 0 CA--C 1.576 1.967 0 O-C-N 120.551 -1.343 . . . . 0.0 113.388 -177.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 112.84 -21.9 17.55 Favored Glycine 0 N--CA 1.496 2.659 0 N-CA-C 117.751 1.86 . . . . 0.0 117.751 -173.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.7 mp -111.5 148.75 32.5 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 119.521 1.66 . . . . 0.0 111.718 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.89 153.19 23.88 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 122.22 1.01 . . . . 0.0 113.106 -177.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 7.4 t -95.21 123.95 38.98 Favored 'General case' 0 CA--C 1.569 1.678 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.529 173.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -93.72 74.54 4.3 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 119.936 -1.727 . . . . 0.0 111.404 178.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -66.83 77.1 0.15 Allowed Glycine 0 N--CA 1.495 2.581 0 N-CA-C 119.968 2.747 . . . . 0.0 119.968 -173.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -109.58 -73.63 0.68 Allowed 'General case' 0 CA--C 1.57 1.746 0 CA-C-N 114.286 -0.957 . . . . 0.0 110.879 -178.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -158.26 139.97 13.75 Favored 'General case' 0 CA--C 1.566 1.581 0 C-N-CA 124.258 1.023 . . . . 0.0 109.569 -178.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 91.6 p -107.72 -54.53 2.48 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 179.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -139.73 -102.06 0.16 Allowed 'General case' 0 N--CA 1.494 1.771 0 CA-C-N 121.598 1.999 . . . . 0.0 110.185 174.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.0 p -130.34 -10.0 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.274 0 N-CA-C 116.938 2.199 . . . . 0.0 116.938 -174.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.48 -53.32 4.36 Favored Glycine 0 N--CA 1.493 2.46 0 N-CA-C 117.529 1.772 . . . . 0.0 117.529 -178.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.4 t -54.52 -51.41 65.24 Favored 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 115.995 1.85 . . . . 0.0 115.995 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.8 pp -92.32 35.08 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 CA-C-O 122.774 1.273 . . . . 0.0 113.775 172.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.286 11.5 p 67.9 -172.4 0.19 Allowed 'General case' 0 CA--C 1.576 1.963 0 C-N-CA 126.535 1.934 . . . . 0.0 112.261 -173.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 35.4 t30 65.06 82.8 0.18 Allowed 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 107.427 -1.324 . . . . 0.0 107.427 -174.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 36.3 p -96.8 -108.96 0.16 Allowed 'General case' 0 CA--C 1.568 1.67 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.132 -169.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -105.43 61.17 0.67 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.916 -1.115 . . . . 0.0 111.578 -176.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -99.55 146.71 26.11 Favored 'General case' 0 CA--C 1.56 1.354 0 CA-C-O 122.337 1.065 . . . . 0.0 109.894 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -98.22 -178.7 32.94 Favored Glycine 0 N--CA 1.485 1.921 0 N-CA-C 115.456 0.943 . . . . 0.0 115.456 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 32.9 mm -108.9 140.9 25.75 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 171.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.8 m -69.7 124.47 24.05 Favored 'General case' 0 CA--C 1.566 1.561 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 174.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 78.8 m-70 -144.69 155.75 43.74 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 122.805 1.288 . . . . 0.0 112.19 175.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -96.58 139.07 33.2 Favored 'General case' 0 CA--C 1.567 1.603 0 O-C-N 121.096 -1.003 . . . . 0.0 111.208 175.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 47.3 t -122.03 78.24 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 CA-C-O 122.675 1.226 . . . . 0.0 108.447 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 177.27 58.69 0.07 OUTLIER Glycine 0 N--CA 1.49 2.256 0 N-CA-C 115.493 0.957 . . . . 0.0 115.493 178.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -83.07 73.25 10.07 Favored 'General case' 0 CA--C 1.574 1.886 0 CA-C-O 122.939 1.352 . . . . 0.0 113.917 -176.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.0 t . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 124.081 1.896 . . . . 0.0 114.077 -176.359 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 78.3 t . . . . . 0 CA--C 1.583 2.225 0 CA-C-O 115.389 -2.243 . . . . 0.0 112.145 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -58.87 -38.53 87.9 Favored 'Trans proline' 0 CA--C 1.569 2.236 0 CA-C-N 126.276 3.277 . . . . 0.0 119.111 -179.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -115.36 79.23 6.73 Favored Pre-proline 0 CA--C 1.58 2.123 0 CA-C-O 118.197 -0.906 . . . . 0.0 112.249 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -74.07 -25.92 13.43 Favored 'Trans proline' 0 CA--C 1.572 2.408 0 N-CA-C 118.794 2.575 . . . . 0.0 118.794 -178.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 68.9 ttt180 70.56 101.98 0.06 Allowed 'General case' 0 N--CA 1.498 1.964 0 C-N-CA 125.34 1.456 . . . . 0.0 113.075 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -79.86 74.63 2.26 Favored Glycine 0 N--CA 1.496 2.648 0 O-C-N 120.797 -1.19 . . . . 0.0 115.765 176.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 10.0 tt -81.38 -7.05 10.4 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.186 0 N-CA-C 118.873 2.916 . . . . 0.0 118.873 -171.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 39.9 mt 81.62 116.87 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.504 0 C-N-CA 125.545 1.538 . . . . 0.0 107.055 -174.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.1 pt -96.13 140.38 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.979 0 CA-C-O 123.249 1.5 . . . . 0.0 112.888 -173.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -153.1 43.48 0.62 Allowed 'General case' 0 CA--C 1.58 2.104 0 N-CA-C 117.01 2.226 . . . . 0.0 117.01 -174.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.8 tp -107.16 127.42 53.49 Favored 'General case' 0 CA--C 1.575 1.918 0 O-C-N 118.96 -2.337 . . . . 0.0 112.502 -175.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -81.03 172.13 14.11 Favored 'General case' 0 CA--C 1.575 1.922 0 O-C-N 119.702 -1.874 . . . . 0.0 114.522 179.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -67.37 143.7 56.2 Favored 'General case' 0 CA--C 1.569 1.674 0 C-N-CA 123.973 0.909 . . . . 0.0 112.006 176.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 98.33 -1.8 59.02 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 117.352 1.701 . . . . 0.0 117.352 -173.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -112.36 149.26 32.73 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-N 118.943 1.372 . . . . 0.0 111.701 -178.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.4 tp -70.67 130.25 41.27 Favored 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -177.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 22.0 p -132.38 150.58 52.13 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.93 0.892 . . . . 0.0 112.79 -178.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.1 tp -84.29 -78.62 0.23 Allowed 'General case' 0 CA--C 1.57 1.728 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 172.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 -94.71 170.19 9.63 Favored 'General case' 0 CA--C 1.57 1.747 0 CA-C-N 120.012 1.278 . . . . 0.0 113.684 174.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.2 p -69.62 -15.33 63.18 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 171.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.6 40.96 0.31 Allowed 'General case' 0 CA--C 1.575 1.919 0 N-CA-C 116.467 2.025 . . . . 0.0 116.467 174.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -136.15 -40.76 0.66 Allowed 'General case' 0 CA--C 1.573 1.845 0 C-N-CA 125.954 1.702 . . . . 0.0 113.08 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 74.2 m -84.64 152.22 23.95 Favored 'General case' 0 CA--C 1.567 1.605 0 N-CA-C 115.837 1.792 . . . . 0.0 115.837 -178.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -59.92 -55.88 28.65 Favored 'General case' 0 N--CA 1.503 2.209 0 C-N-CA 124.55 1.14 . . . . 0.0 109.896 173.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.6 m -82.27 102.1 10.96 Favored 'General case' 0 CA--C 1.569 1.686 0 N-CA-C 102.58 -3.119 . . . . 0.0 102.58 168.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -71.03 78.26 0.66 Allowed 'General case' 0 CA--C 1.569 1.697 0 CA-C-O 124.095 1.902 . . . . 0.0 114.583 -171.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 47.0 t -152.6 97.78 2.29 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-N 113.338 -1.756 . . . . 0.0 111.538 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 13.5 t -83.82 111.38 19.15 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 104.979 -2.23 . . . . 0.0 104.979 171.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.6 124.63 40.65 Favored 'General case' 0 CA--C 1.557 1.238 0 CA-C-O 122.472 1.129 . . . . 0.0 111.642 -172.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 -80.33 137.58 36.59 Favored 'General case' 0 CA--C 1.568 1.664 0 CA-C-O 122.698 1.237 . . . . 0.0 113.905 -174.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -63.98 -24.91 67.9 Favored 'General case' 0 CA--C 1.58 2.127 0 N-CA-C 117.5 2.407 . . . . 0.0 117.5 173.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.334 40.3 p 124.33 95.97 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 128.991 2.916 . . . . 0.0 108.496 174.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.414 7.5 tp 56.64 -49.11 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 N-CA-C 118.751 2.871 . . . . 0.0 118.751 177.669 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.6 tp -78.87 90.37 4.71 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 122.102 2.228 . . . . 0.0 108.522 173.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.3 p -52.51 103.95 0.08 Allowed 'General case' 0 CA--C 1.575 1.912 1 N-CA-C 122.514 4.265 . . . . 0.0 122.514 -171.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.0 tp -146.3 83.05 1.61 Allowed 'General case' 0 CA--C 1.572 1.799 0 N-CA-C 101.772 -3.418 . . . . 0.0 101.772 171.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.8 m -98.14 144.58 27.46 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -171.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.9 ttp180 -134.09 138.8 45.52 Favored 'General case' 0 CA--C 1.567 1.602 0 C-N-CA 124.372 1.069 . . . . 0.0 110.16 -175.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 65.1 m -68.04 144.87 54.92 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 119.694 -1.879 . . . . 0.0 114.017 177.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.75 172.81 12.18 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-N 113.416 -1.72 . . . . 0.0 114.381 -173.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 33.2 tp -81.71 143.79 31.6 Favored 'General case' 0 CA--C 1.567 1.626 0 CA-C-O 122.411 1.1 . . . . 0.0 113.196 -175.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.1 ptpt -66.2 145.53 55.68 Favored 'General case' 0 CA--C 1.574 1.874 0 CA-C-O 122.033 0.921 . . . . 0.0 113.271 174.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.13 159.75 29.53 Favored 'General case' 0 CA--C 1.569 1.682 0 N-CA-C 117.681 2.474 . . . . 0.0 117.681 -172.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.9 mtt180 -124.65 170.72 10.68 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 112.876 -1.966 . . . . 0.0 111.528 -177.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -45.34 125.87 5.93 Favored 'General case' 0 CA--C 1.571 1.78 0 N-CA-C 116.555 2.057 . . . . 0.0 116.555 -174.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 75.68 18.27 2.21 Favored 'General case' 0 N--CA 1.506 2.353 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -173.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.8 t -110.27 149.15 30.58 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 120.356 -1.465 . . . . 0.0 112.392 175.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -71.76 119.81 16.47 Favored 'General case' 0 CA--C 1.57 1.749 0 C-N-CA 124.799 1.24 . . . . 0.0 111.28 -179.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -123.87 154.35 39.78 Favored 'General case' 0 CA--C 1.564 1.499 0 CA-C-O 123.305 1.526 . . . . 0.0 114.427 -174.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.3 t -93.65 109.55 21.18 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 171.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.0 10.13 3.11 Favored 'General case' 0 CA--C 1.582 2.203 0 N-CA-C 118.325 2.713 . . . . 0.0 118.325 -179.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 44.4 p90 -143.69 160.44 40.7 Favored 'General case' 0 CA--C 1.57 1.718 0 C-N-CA 126.47 1.908 . . . . 0.0 111.076 -173.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.7 p -131.2 136.52 48.34 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 122.675 1.226 . . . . 0.0 109.637 172.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -99.78 -136.74 0.3 Allowed 'General case' 0 CA--C 1.566 1.577 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 173.305 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -128.18 74.12 1.52 Allowed 'General case' 0 CA--C 1.568 1.667 0 N-CA-C 103.414 -2.81 . . . . 0.0 103.414 170.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 161.33 -146.2 11.94 Favored Glycine 0 N--CA 1.488 2.11 0 N-CA-C 117.294 1.678 . . . . 0.0 117.294 -175.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.0 t -91.35 147.18 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 CA-C-O 122.92 1.343 . . . . 0.0 112.52 -166.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -119.86 137.13 54.19 Favored 'General case' 0 CA--C 1.556 1.208 0 CA-C-O 122.349 1.071 . . . . 0.0 110.787 -174.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -76.08 -9.74 58.86 Favored 'General case' 0 CA--C 1.582 2.196 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 174.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 11.3 ptpt -163.91 125.01 2.26 Favored 'General case' 0 CA--C 1.567 1.608 0 N-CA-C 105.965 -1.865 . . . . 0.0 105.965 175.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 64.0 m -62.67 144.01 96.34 Favored Pre-proline 0 CA--C 1.589 2.474 0 N-CA-C 117.123 2.268 . . . . 0.0 117.123 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -56.93 170.44 1.45 Allowed 'Trans proline' 0 CA--C 1.575 2.552 0 C-N-CA 123.067 2.511 . . . . 0.0 117.148 174.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 60.3 m -77.18 163.68 26.34 Favored 'General case' 0 CA--C 1.578 2.045 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -74.63 173.03 11.01 Favored 'General case' 0 CA--C 1.578 2.036 0 N-CA-C 117.351 2.352 . . . . 0.0 117.351 -175.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 53.1 tpt85 -66.94 113.47 4.99 Favored 'General case' 0 CA--C 1.571 1.756 0 O-C-N 120.524 -1.36 . . . . 0.0 111.6 174.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.63 -0.3 59.51 Favored Glycine 0 N--CA 1.499 2.841 0 N-CA-C 118.262 2.065 . . . . 0.0 118.262 -173.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.9 tt -135.79 132.81 37.2 Favored 'General case' 0 CA--C 1.568 1.671 0 CA-C-N 119.401 1.6 . . . . 0.0 107.742 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.32 159.85 14.73 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 116.445 2.017 . . . . 0.0 116.445 -171.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.9 t -93.11 127.62 38.72 Favored 'General case' 0 CA--C 1.57 1.747 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.653 173.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -97.96 78.64 2.56 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 119.813 -1.804 . . . . 0.0 110.329 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -70.44 71.56 0.64 Allowed Glycine 0 N--CA 1.496 2.675 0 N-CA-C 118.999 2.359 . . . . 0.0 118.999 -174.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -112.47 -67.79 0.97 Allowed 'General case' 0 CA--C 1.57 1.731 0 C-N-CA 123.853 0.861 . . . . 0.0 110.364 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt -163.25 136.24 5.54 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 124.088 0.955 . . . . 0.0 109.286 174.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.6 t -141.61 96.01 2.91 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.672 -1.267 . . . . 0.0 109.816 178.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 30.0 tp 66.31 101.59 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 125.392 1.477 . . . . 0.0 113.503 177.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 86.0 t -63.32 -40.49 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.352 0 N-CA-C 114.73 1.382 . . . . 0.0 114.73 -178.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -87.45 26.24 7.36 Favored Glycine 0 N--CA 1.495 2.571 0 N-CA-C 119.864 2.706 . . . . 0.0 119.864 175.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 87.9 p -87.27 57.78 4.64 Favored 'General case' 0 N--CA 1.497 1.906 0 CA-C-N 120.675 2.238 . . . . 0.0 113.331 174.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.376 13.7 pt 59.53 -61.71 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.514 2.758 0 C-N-CA 126.543 1.937 . . . . 0.0 114.316 -173.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 38.9 p -118.46 156.82 28.37 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 122.849 1.309 . . . . 0.0 109.785 173.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -147.36 90.66 1.89 Allowed 'General case' 0 CA--C 1.562 1.412 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . 0.276 2.5 t -104.08 -95.69 0.32 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 123.613 0.765 . . . . 0.0 109.025 -177.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -126.34 71.22 1.26 Allowed 'General case' 0 N--CA 1.493 1.713 0 CA-C-N 120.531 1.514 . . . . 0.0 109.805 174.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -98.69 150.86 21.35 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 122.741 1.258 . . . . 0.0 110.392 177.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -142.02 -171.21 12.9 Favored Glycine 0 N--CA 1.48 1.58 0 CA-C-N 115.351 -0.841 . . . . 0.0 115.194 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 32.3 mm -114.4 137.24 48.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 174.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 64.5 m -67.87 125.95 27.9 Favored 'General case' 0 CA--C 1.568 1.637 0 O-C-N 120.903 -1.123 . . . . 0.0 113.349 174.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -143.22 156.97 44.87 Favored 'General case' 0 CA--C 1.561 1.394 0 CA-C-O 123.43 1.585 . . . . 0.0 111.662 175.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -98.23 108.55 21.28 Favored 'General case' 0 CA--C 1.563 1.478 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 174.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.6 p -95.69 68.44 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 CA-C-O 123.579 1.656 . . . . 0.0 111.81 -174.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.02 54.91 4.61 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 117.677 1.831 . . . . 0.0 117.677 -177.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . 0.323 4.9 ptm180 45.02 -106.54 0.11 Allowed 'General case' 0 CA--C 1.579 2.077 0 N-CA-C 116.248 1.944 . . . . 0.0 116.248 -179.286 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 10.3 t . . . . . 0 N--CA 1.498 1.952 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 176.36 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 74.7 t . . . . . 0 CA--C 1.581 2.161 0 CA-C-O 115.914 -1.993 . . . . 0.0 110.967 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -64.23 -35.25 52.9 Favored 'Trans proline' 0 CA--C 1.568 2.213 0 CA-C-N 125.828 3.117 . . . . 0.0 118.452 -175.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 50.62 71.74 1.45 Allowed Pre-proline 0 CA--C 1.589 2.476 0 N-CA-C 115.945 1.831 . . . . 0.0 115.945 174.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -81.7 75.76 4.68 Favored 'Trans proline' 0 CA--C 1.572 2.391 0 C-N-CA 122.247 1.965 . . . . 0.0 115.932 -174.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -135.85 81.19 1.87 Allowed 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.913 0.864 . . . . 0.0 108.736 175.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 160.21 109.58 0.25 Allowed Glycine 0 N--CA 1.486 2.023 0 O-C-N 121.21 -0.931 . . . . 0.0 112.119 -174.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 41.9 mm -85.93 -76.87 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 CA-C-O 119.191 -0.433 . . . . 0.0 110.1 -176.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.314 9.8 tp -151.02 -115.95 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 174.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -99.43 -149.2 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.583 2.233 0 CA-C-N 121.075 1.761 . . . . 0.0 110.484 174.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 -146.57 111.21 5.22 Favored 'General case' 0 CA--C 1.573 1.848 0 O-C-N 119.031 -2.293 . . . . 0.0 113.602 -174.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 17.8 tp -96.68 96.68 8.79 Favored 'General case' 0 CA--C 1.568 1.636 0 O-C-N 120.15 -1.594 . . . . 0.0 113.442 174.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -98.24 151.68 20.21 Favored 'General case' 0 CA--C 1.578 2.026 0 N-CA-C 106.101 -1.814 . . . . 0.0 106.101 166.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -81.21 102.6 10.44 Favored 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 104.125 -2.546 . . . . 0.0 104.125 171.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 128.57 26.87 0.92 Allowed Glycine 0 CA--C 1.546 2.004 0 CA-C-N 113.547 -1.661 . . . . 0.0 115.669 -172.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -93.35 105.62 17.67 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 119.886 1.843 . . . . 0.0 108.167 172.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 mp -72.56 104.54 3.89 Favored 'General case' 0 N--CA 1.493 1.725 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 175.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 2.5 p -111.47 173.05 6.53 Favored 'General case' 0 CA--C 1.563 1.447 0 N-CA-C 117.888 2.551 . . . . 0.0 117.888 -171.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.1 tp -94.46 -73.71 0.57 Allowed 'General case' 0 CA--C 1.579 2.058 0 N-CA-C 105.965 -1.865 . . . . 0.0 105.965 170.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -100.7 -165.0 1.16 Allowed 'General case' 0 CA--C 1.583 2.249 0 C-N-CA 125.217 1.407 . . . . 0.0 113.707 172.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.1 m -93.61 -0.24 56.25 Favored 'General case' 0 N--CA 1.504 2.237 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 173.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.18 11.16 1.98 Allowed 'General case' 0 CA--C 1.578 2.037 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 174.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -96.2 -33.39 12.04 Favored 'General case' 0 CA--C 1.587 2.389 0 C-N-CA 125.766 1.627 . . . . 0.0 111.598 172.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . 0.305 85.0 m -87.6 131.33 34.45 Favored 'General case' 0 CA--C 1.587 2.388 0 C-N-CA 125.477 1.511 . . . . 0.0 109.674 172.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -41.33 -50.99 3.74 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 121.676 3.954 . . . . 0.0 121.676 -171.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 100.0 p -80.09 -77.33 0.19 Allowed 'General case' 0 CA--C 1.569 1.682 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 174.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -178.11 78.36 0.02 OUTLIER 'General case' 0 CA--C 1.571 1.752 0 N-CA-C 104.147 -2.538 . . . . 0.0 104.147 172.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 40.6 t -142.1 59.8 1.47 Allowed 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 116.203 1.927 . . . . 0.0 116.203 -173.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.3 t -92.84 119.53 32.27 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 169.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.91 115.73 31.1 Favored 'General case' 0 CA--C 1.569 1.703 0 CA-C-O 123.415 1.579 . . . . 0.0 113.745 -171.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -87.91 118.04 27.18 Favored 'General case' 0 CA--C 1.565 1.55 0 C-N-CA 124.775 1.23 . . . . 0.0 111.201 -178.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -83.76 44.2 0.97 Allowed 'General case' 0 CA--C 1.584 2.255 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 176.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.412 0.7 OUTLIER 106.54 176.65 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.699 0 C-N-CA 128.842 2.857 . . . . 0.0 112.167 -174.808 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 28.1 mm -54.07 -67.54 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.527 0 O-C-N 119.532 -1.98 . . . . 0.0 115.296 -173.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 pp -97.68 49.97 1.04 Allowed 'General case' 0 N--CA 1.509 2.486 0 CA-C-N 120.517 1.508 . . . . 0.0 113.451 176.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.2 p -102.33 -3.52 27.02 Favored 'General case' 0 N--CA 1.492 1.663 1 N-CA-C 121.906 4.039 . . . . 0.0 121.906 -172.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 21.7 tp 70.6 120.16 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.174 0 CA-C-N 120.288 1.403 . . . . 0.0 109.566 -173.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.7 m -94.78 124.63 38.93 Favored 'General case' 0 CA--C 1.561 1.386 0 O-C-N 120.377 -1.452 . . . . 0.0 114.741 -172.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.3 ttt85 -132.1 134.21 45.2 Favored 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 124.43 1.092 . . . . 0.0 110.283 -175.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 89.3 m -70.35 151.04 45.68 Favored 'General case' 0 CA--C 1.56 1.355 0 O-C-N 119.511 -1.993 . . . . 0.0 114.224 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.29 -174.21 3.88 Favored 'General case' 0 CA--C 1.565 1.531 0 CA-C-N 113.031 -1.895 . . . . 0.0 113.374 -173.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.5 mt -79.58 149.4 31.39 Favored 'General case' 0 CA--C 1.57 1.737 0 CA-C-O 122.225 1.012 . . . . 0.0 112.191 175.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -69.35 153.25 43.89 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 175.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.07 151.51 40.15 Favored 'General case' 0 CA--C 1.57 1.743 0 CA-C-O 124.242 1.972 . . . . 0.0 113.941 -174.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -118.99 168.41 10.83 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-N 113.427 -1.715 . . . . 0.0 110.968 -175.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -53.1 120.9 6.47 Favored 'General case' 0 CA--C 1.571 1.774 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -173.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 79.48 25.53 0.42 Allowed 'General case' 0 N--CA 1.505 2.317 0 C-N-CA 125.439 1.496 . . . . 0.0 113.789 -172.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.7 t -126.61 154.1 44.42 Favored 'General case' 0 CA--C 1.567 1.618 0 O-C-N 120.378 -1.451 . . . . 0.0 110.492 174.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -64.59 130.84 45.19 Favored 'General case' 0 CA--C 1.574 1.883 0 N-CA-C 116.764 2.135 . . . . 0.0 116.764 -173.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 24.5 p -141.04 141.99 34.25 Favored 'General case' 0 CA--C 1.563 1.47 0 CA-C-N 113.112 -1.858 . . . . 0.0 113.099 177.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.5 t -87.01 134.39 33.49 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 170.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.43 -26.16 62.63 Favored 'General case' 0 CA--C 1.578 2.027 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 -177.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -127.46 157.37 40.24 Favored 'General case' 0 CA--C 1.572 1.801 0 C-N-CA 125.448 1.499 . . . . 0.0 107.897 172.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 17.6 p -129.24 160.46 32.88 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 124.146 1.927 . . . . 0.0 110.308 172.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.288 0.7 OUTLIER -96.49 -121.99 0.12 Allowed 'General case' 0 CA--C 1.575 1.917 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 174.347 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.37 3.15 2.56 Favored 'General case' 0 CA--C 1.589 2.452 0 O-C-N 119.62 -1.925 . . . . 0.0 112.622 171.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -99.85 -162.12 28.83 Favored Glycine 0 N--CA 1.481 1.675 0 O-C-N 120.557 -1.339 . . . . 0.0 113.403 -175.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.9 t -79.41 137.42 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 CA-C-O 123.093 1.425 . . . . 0.0 109.86 -175.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -111.58 140.25 46.35 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -171.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -71.99 -1.73 15.62 Favored 'General case' 0 CA--C 1.587 2.389 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 174.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.3 123.62 0.97 Allowed 'General case' 0 CA--C 1.574 1.883 0 C-N-CA 127.879 2.472 . . . . 0.0 107.104 -174.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 36.2 m -70.73 129.07 90.27 Favored Pre-proline 0 CA--C 1.594 2.661 0 O-C-N 118.973 -2.33 . . . . 0.0 111.032 173.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -76.41 76.5 3.91 Favored 'Trans proline' 0 CA--C 1.573 2.427 0 N-CA-C 119.236 2.745 . . . . 0.0 119.236 -172.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 58.5 m 60.4 145.39 0.01 OUTLIER 'General case' 0 CA--C 1.578 2.041 0 N-CA-C 116.998 2.222 . . . . 0.0 116.998 174.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -65.78 162.01 19.65 Favored 'General case' 0 CA--C 1.578 2.038 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 174.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -63.02 109.28 1.43 Allowed 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.768 -1.207 . . . . 0.0 112.503 -177.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 112.92 -23.39 14.57 Favored Glycine 0 N--CA 1.498 2.812 0 N-CA-C 117.606 1.802 . . . . 0.0 117.606 -173.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.3 tp -99.1 143.22 29.62 Favored 'General case' 0 CA--C 1.572 1.79 0 CA-C-N 118.509 1.154 . . . . 0.0 111.625 -178.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -98.54 159.11 15.17 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.472 -1.393 . . . . 0.0 114.087 -174.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 10.4 t -93.8 123.7 37.31 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.687 172.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -96.2 121.8 38.36 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.711 -1.243 . . . . 0.0 108.782 176.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -70.58 64.49 0.83 Allowed Glycine 0 N--CA 1.497 2.72 0 N-CA-C 119.702 2.641 . . . . 0.0 119.702 -174.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -84.94 79.54 9.6 Favored 'General case' 0 CA--C 1.571 1.773 0 C-N-CA 124.085 0.954 . . . . 0.0 110.679 177.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt 67.19 163.23 0.19 Allowed 'General case' 0 N--CA 1.502 2.147 0 CA-C-O 123.117 1.437 . . . . 0.0 114.635 -176.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 28.7 m -156.31 -78.29 0.09 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.181 -1.574 . . . . 0.0 109.404 174.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -89.8 65.97 6.91 Favored 'General case' 0 CA--C 1.576 1.958 0 O-C-N 120.403 -1.436 . . . . 0.0 112.55 -177.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.5 p -92.0 -15.28 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.294 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 -178.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -148.99 -71.61 0.01 OUTLIER Glycine 0 N--CA 1.493 2.464 0 O-C-N 120.592 -1.318 . . . . 0.0 114.603 178.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 61.1 m -91.89 157.76 16.67 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 121.818 0.818 . . . . 0.0 112.849 174.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.5 pp -79.72 98.13 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.157 0 N-CA-C 104.825 -2.287 . . . . 0.0 104.825 173.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.275 16.7 p 69.58 163.26 0.24 Allowed 'General case' 0 CA--C 1.579 2.091 0 C-N-CA 125.261 1.424 . . . . 0.0 111.085 -170.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.1 t30 56.78 63.8 1.84 Allowed 'General case' 0 N--CA 1.514 2.742 0 O-C-N 119.791 -1.818 . . . . 0.0 108.71 -172.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . 0.313 1.6 t -136.23 -111.86 0.19 Allowed 'General case' 0 CA--C 1.568 1.672 0 C-N-CA 123.757 0.823 . . . . 0.0 110.484 -168.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -150.42 113.26 4.77 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 178.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -109.32 176.62 5.02 Favored 'General case' 0 CA--C 1.571 1.786 0 CA-C-O 122.027 0.918 . . . . 0.0 112.883 -172.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.65 -179.2 3.23 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 118.518 2.167 . . . . 0.0 118.518 178.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 39.3 mm -126.32 139.2 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.283 -1.128 . . . . 0.0 110.461 -174.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 59.7 m -69.11 128.35 36.33 Favored 'General case' 0 CA--C 1.57 1.717 0 O-C-N 120.291 -1.506 . . . . 0.0 114.464 174.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -141.7 158.99 43.13 Favored 'General case' 0 CA--C 1.565 1.547 0 CA-C-O 123.309 1.528 . . . . 0.0 111.922 175.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -97.65 128.14 44.13 Favored 'General case' 0 CA--C 1.562 1.433 0 CA-C-O 122.669 1.223 . . . . 0.0 111.385 178.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 12.3 p -146.42 74.41 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 CA-C-O 123.044 1.402 . . . . 0.0 109.093 177.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 157.16 -57.07 0.38 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 117.039 1.575 . . . . 0.0 117.039 -175.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 -76.14 -76.5 0.16 Allowed 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 118.54 1.17 . . . . 0.0 113.681 -172.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 95.9 p . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 124.294 1.997 . . . . 0.0 112.188 -179.766 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 8.9 p . . . . . 0 CA--C 1.587 2.379 0 CA-C-O 114.337 -2.744 . . . . 0.0 116.67 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -63.86 89.56 0.15 Allowed 'Trans proline' 0 CA--C 1.573 2.442 0 CA-C-N 127.344 3.658 . . . . 0.0 116.51 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -146.97 129.34 7.71 Favored Pre-proline 0 CA--C 1.58 2.106 0 CA-C-O 117.696 -1.145 . . . . 0.0 109.199 -175.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -75.67 77.82 3.24 Favored 'Trans proline' 0 CA--C 1.573 2.442 0 C-N-CA 122.753 2.302 . . . . 0.0 116.124 -174.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 72.5 mtm180 -100.87 -1.56 34.37 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 -177.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 89.45 -69.95 2.47 Favored Glycine 0 N--CA 1.494 2.522 0 CA-C-N 121.082 1.764 . . . . 0.0 115.617 -179.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 62.2 mt -91.61 82.08 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 176.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 63.0 mt -103.67 101.04 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -97.95 -69.12 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -175.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.3 0.5 OUTLIER 53.48 76.26 0.22 Allowed 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 116.952 2.204 . . . . 0.0 116.952 177.937 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.5 tp -129.77 126.21 37.62 Favored 'General case' 0 CA--C 1.574 1.895 0 C-N-CA 124.49 1.116 . . . . 0.0 108.934 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -80.31 167.34 20.38 Favored 'General case' 0 CA--C 1.573 1.862 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -174.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -63.72 138.15 58.37 Favored 'General case' 0 CA--C 1.572 1.815 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -176.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.81 -11.33 38.25 Favored Glycine 0 N--CA 1.496 2.653 0 N-CA-C 118.391 2.116 . . . . 0.0 118.391 -175.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 82.3 mm-40 -100.21 137.42 38.67 Favored 'General case' 0 CA--C 1.564 1.506 0 CA-C-N 118.99 1.395 . . . . 0.0 111.081 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 77.7 mt -67.45 134.3 51.14 Favored 'General case' 0 CA--C 1.573 1.853 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -174.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.5 p -122.97 177.84 5.32 Favored 'General case' 0 CA--C 1.573 1.849 0 CA-C-O 123.029 1.395 . . . . 0.0 113.408 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.9 mt -109.45 -74.41 0.66 Allowed 'General case' 0 CA--C 1.574 1.889 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 171.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.1 p30 -91.39 -173.23 3.53 Favored 'General case' 0 CA--C 1.581 2.154 0 C-N-CA 124.607 1.163 . . . . 0.0 113.181 172.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.8 t -94.4 -4.94 47.49 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 116.921 2.193 . . . . 0.0 116.921 174.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.44 1.87 15.24 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 117.382 2.364 . . . . 0.0 117.382 174.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -95.27 -20.92 18.78 Favored 'General case' 0 CA--C 1.57 1.717 0 N-CA-C 115.966 1.839 . . . . 0.0 115.966 -175.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.0 m -81.44 -131.72 0.03 OUTLIER 'General case' 0 CA--C 1.579 2.074 0 CA-C-N 121.236 1.834 . . . . 0.0 114.124 -175.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -72.73 -82.8 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.354 0 O-C-N 119.423 -2.048 . . . . 0.0 111.328 -177.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.6 p -88.79 -63.07 1.35 Allowed 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 121.966 0.889 . . . . 0.0 110.744 172.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -170.05 84.81 0.12 Allowed 'General case' 0 CA--C 1.569 1.706 0 N-CA-C 105.159 -2.163 . . . . 0.0 105.159 178.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 41.9 t -155.32 94.44 1.61 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 119.825 -1.797 . . . . 0.0 115.118 -176.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.8 t -114.81 139.39 49.77 Favored 'General case' 0 CA--C 1.56 1.364 0 CA-C-O 121.759 0.79 . . . . 0.0 108.988 171.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.46 124.61 29.06 Favored 'General case' 0 CA--C 1.573 1.837 0 CA-C-O 122.106 0.955 . . . . 0.0 109.124 174.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -27.45 4.93 0.0 OUTLIER 'General case' 0 CA--C 1.592 2.586 3 N-CA-C 142.845 11.794 . . . . 0.0 142.845 -166.852 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . 0.261 1.3 p30 -24.65 72.49 0.0 OUTLIER 'General case' 0 N--CA 1.531 3.592 2 CA-C-N 131.633 6.56 . . . . 0.0 125.005 -167.732 . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.4 t -139.85 14.74 2.49 Favored 'General case' 0 CA--C 1.583 2.235 0 CA-C-N 114.05 -1.432 . . . . 0.0 113.957 173.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.0 pt -140.12 -59.04 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 CA-C-N 120.054 1.297 . . . . 0.0 111.535 174.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 93.8 mt -131.86 -68.22 0.65 Allowed 'General case' 0 N--CA 1.498 1.936 0 CA-C-N 120.513 1.506 . . . . 0.0 113.171 -174.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.7 p -90.01 163.95 14.71 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 -174.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.6 tp -66.98 163.02 20.71 Favored 'General case' 0 CA--C 1.584 2.282 0 O-C-N 121.517 -0.739 . . . . 0.0 111.9 173.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.1 m -91.96 127.62 37.5 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 119.885 -1.759 . . . . 0.0 111.732 -172.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -111.66 154.51 24.82 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.86 174.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 55.7 m -63.57 151.5 41.35 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 118.751 -2.468 . . . . 0.0 112.099 174.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . 0.275 . . -133.82 -172.64 3.03 Favored 'General case' 0 CA--C 1.567 1.612 0 CA-C-N 113.123 -1.853 . . . . 0.0 110.663 -175.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 94.4 mt -125.0 150.42 46.72 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.856 -1.152 . . . . 0.0 112.008 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -63.9 144.03 57.39 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.383 -0.823 . . . . 0.0 111.456 173.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.96 147.03 35.13 Favored 'General case' 0 CA--C 1.566 1.586 0 CA-C-O 124.678 2.18 . . . . 0.0 116.246 -173.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -101.56 170.27 8.3 Favored 'General case' 0 CA--C 1.56 1.336 0 CA-C-N 111.449 -2.614 . . . . 0.0 111.161 -178.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -59.26 124.26 19.4 Favored 'General case' 0 CA--C 1.57 1.741 0 O-C-N 120.84 -1.162 . . . . 0.0 112.851 -175.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 83.21 22.01 0.17 Allowed 'General case' 0 N--CA 1.506 2.359 0 C-N-CA 125.602 1.561 . . . . 0.0 113.859 -172.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.4 t -121.28 150.1 41.91 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.059 -1.651 . . . . 0.0 111.657 174.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -69.08 141.7 54.66 Favored 'General case' 0 CA--C 1.57 1.713 0 CA-C-O 123.305 1.526 . . . . 0.0 113.391 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 8.5 p -140.33 148.81 41.91 Favored 'General case' 0 CA--C 1.564 1.514 0 CA-C-N 113.127 -1.851 . . . . 0.0 113.387 -175.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.5 p -77.26 110.51 12.03 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 120.878 -1.138 . . . . 0.0 108.421 173.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -76.3 20.23 0.22 Allowed 'General case' 0 CA--C 1.576 1.963 0 N-CA-C 120.46 3.504 . . . . 0.0 120.46 -172.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -158.1 -56.47 0.07 Allowed 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 124.869 1.268 . . . . 0.0 113.348 -174.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.8 p 72.29 147.12 0.08 Allowed 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 127.607 2.363 . . . . 0.0 113.702 -174.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -100.06 -139.24 0.32 Allowed 'General case' 0 CA--C 1.576 1.956 0 CA-C-N 113.143 -1.844 . . . . 0.0 107.04 172.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -136.78 68.82 1.42 Allowed 'General case' 0 CA--C 1.567 1.625 0 CA-C-O 123.796 1.76 . . . . 0.0 107.921 169.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -177.66 -156.96 17.52 Favored Glycine 0 CA--C 1.544 1.858 0 CA-C-N 113.781 -1.554 . . . . 0.0 111.522 -176.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 1.2 t -75.17 154.47 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.213 0 O-C-N 121.283 -1.127 . . . . 0.0 112.928 -171.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -123.11 139.1 54.41 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 116.581 2.067 . . . . 0.0 116.581 -171.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -68.71 -38.88 80.59 Favored 'General case' 0 N--CA 1.502 2.128 0 N-CA-C 113.853 1.056 . . . . 0.0 113.853 172.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -143.01 109.14 5.24 Favored 'General case' 0 CA--C 1.563 1.479 0 N-CA-C 104.381 -2.451 . . . . 0.0 104.381 174.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 49.2 m -52.23 150.81 7.88 Favored Pre-proline 0 CA--C 1.588 2.415 0 N-CA-C 116.085 1.883 . . . . 0.0 116.085 178.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -63.25 166.28 15.21 Favored 'Trans proline' 0 CA--C 1.572 2.385 0 C-N-CA 122.308 2.005 . . . . 0.0 115.924 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 80.3 m -69.2 150.73 47.16 Favored 'General case' 0 CA--C 1.572 1.805 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 178.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -71.24 163.47 27.58 Favored 'General case' 0 CA--C 1.573 1.857 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 174.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -54.55 118.55 4.26 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 -174.243 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.04 -29.49 9.66 Favored Glycine 0 CA--C 1.556 2.648 0 CA-C-N 114.153 -1.385 . . . . 0.0 115.851 -172.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.9 mp -99.57 144.11 29.05 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-O 122.77 1.271 . . . . 0.0 112.115 -177.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -112.16 159.14 18.84 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 124.16 0.984 . . . . 0.0 112.607 -177.079 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 3.0 t -88.83 80.79 7.08 Favored 'General case' 0 CA--C 1.575 1.926 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 177.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -100.14 103.41 14.9 Favored 'General case' 0 CA--C 1.569 1.675 0 O-C-N 120.932 -1.105 . . . . 0.0 113.307 -174.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 174.36 -103.98 0.19 Allowed Glycine 0 N--CA 1.49 2.288 0 O-C-N 120.519 -1.363 . . . . 0.0 113.726 174.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -94.24 132.42 38.83 Favored 'General case' 0 CA--C 1.57 1.731 0 CA-C-O 122.535 1.16 . . . . 0.0 111.098 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -75.12 113.13 12.11 Favored 'General case' 0 CA--C 1.567 1.629 0 O-C-N 121.383 -0.823 . . . . 0.0 113.104 -174.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 50.9 m -73.07 -10.64 60.0 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 119.693 3.219 . . . . 0.0 119.693 -174.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.6 mp -81.53 71.88 8.55 Favored 'General case' 0 CA--C 1.575 1.924 0 CA-C-N 121.098 1.772 . . . . 0.0 111.783 178.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 79.0 t -120.83 -60.5 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 C-N-CA 123.789 0.836 . . . . 0.0 110.18 -177.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -136.15 54.02 0.74 Allowed Glycine 0 N--CA 1.494 2.565 0 N-CA-C 116.652 1.421 . . . . 0.0 116.652 177.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 70.5 m 49.56 -106.54 0.21 Allowed 'General case' 0 N--CA 1.503 2.177 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 176.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.4 pp -98.01 63.0 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 CA-C-O 123.776 1.75 . . . . 0.0 113.444 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 17.3 p -130.04 154.56 47.3 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 122.903 1.335 . . . . 0.0 112.208 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -83.47 73.04 10.23 Favored 'General case' 0 CA--C 1.574 1.889 0 CA-C-O 122.36 1.076 . . . . 0.0 110.069 174.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.6 t -106.56 -67.18 0.95 Allowed 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 115.226 1.565 . . . . 0.0 115.226 -172.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 -143.17 128.3 18.63 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.108 0.963 . . . . 0.0 109.545 -174.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -136.77 144.46 43.78 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-O 122.495 1.14 . . . . 0.0 111.977 178.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -78.74 163.92 50.1 Favored Glycine 0 N--CA 1.489 2.205 0 CA-C-N 115.762 -0.654 . . . . 0.0 114.595 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 35.2 mm -103.63 132.57 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 69.6 m -62.14 119.75 9.56 Favored 'General case' 0 CA--C 1.564 1.502 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 176.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -143.99 154.1 42.93 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-O 122.324 1.059 . . . . 0.0 110.82 175.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -92.89 87.51 5.83 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 123.761 1.744 . . . . 0.0 110.374 -174.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.4 t -127.22 87.58 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 CA-C-N 113.165 -1.834 . . . . 0.0 107.001 -174.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -50.42 -39.88 37.47 Favored Glycine 0 N--CA 1.5 2.963 0 N-CA-C 119.932 2.733 . . . . 0.0 119.932 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 56.5 ttp180 -81.81 84.88 6.74 Favored 'General case' 0 CA--C 1.574 1.894 0 CA-C-N 118.381 1.09 . . . . 0.0 110.542 169.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.501 2.079 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 -179.159 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 15.1 m . . . . . 0 CA--C 1.579 2.063 0 CA-C-O 118.721 -0.657 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -55.26 -33.06 83.43 Favored 'Trans proline' 0 CA--C 1.573 2.435 0 N-CA-C 118.523 2.47 . . . . 0.0 118.523 174.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 p30 -104.2 107.37 57.13 Favored Pre-proline 0 CA--C 1.578 2.056 0 CA-C-O 117.331 -1.319 . . . . 0.0 109.813 174.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -56.85 -42.74 61.38 Favored 'Trans proline' 0 CA--C 1.569 2.238 0 N-CA-C 119.079 2.684 . . . . 0.0 119.079 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 71.6 -54.02 0.68 Allowed 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -80.92 56.28 4.8 Favored Glycine 0 N--CA 1.496 2.68 0 N-CA-C 118.654 2.222 . . . . 0.0 118.654 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 50.7 mm -124.01 -74.94 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 176.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.8 tp -154.59 134.11 3.67 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.798 0 O-C-N 120.977 -1.077 . . . . 0.0 109.43 176.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.6 pt -97.46 -123.75 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.586 2.342 0 O-C-N 121.397 -0.814 . . . . 0.0 109.718 174.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 71.7 m-80 58.15 74.78 0.41 Allowed 'General case' 0 CA--C 1.582 2.205 0 N-CA-C 118.015 2.598 . . . . 0.0 118.015 177.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 48.6 tp -103.27 142.82 33.54 Favored 'General case' 0 CA--C 1.58 2.107 0 O-C-N 119.734 -1.854 . . . . 0.0 109.178 173.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.86 179.68 7.7 Favored 'General case' 0 CA--C 1.572 1.798 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -174.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -74.4 168.47 19.63 Favored 'General case' 0 CA--C 1.575 1.916 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.97 13.63 74.28 Favored Glycine 0 CA--C 1.561 2.929 0 N-CA-C 117.13 1.612 . . . . 0.0 117.13 -172.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -117.91 143.27 46.48 Favored 'General case' 0 CA--C 1.567 1.609 0 C-N-CA 125.21 1.404 . . . . 0.0 110.504 -173.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.3 tt -71.94 131.11 42.5 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.872 -1.143 . . . . 0.0 111.271 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.54 ' SG ' ' O ' ' A' ' 19' ' ' ASN . 0.4 OUTLIER -135.96 154.25 51.16 Favored 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -173.751 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.5 mt -100.72 -67.56 0.85 Allowed 'General case' 0 CA--C 1.576 1.969 0 CA-C-N 113.622 -1.626 . . . . 0.0 108.983 171.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.54 ' O ' ' SG ' ' A' ' 17' ' ' CYS . 62.1 m-20 -108.18 -171.58 1.89 Allowed 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 120.776 1.625 . . . . 0.0 114.894 173.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.7 m -64.61 -30.69 71.71 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 118.92 -2.363 . . . . 0.0 113.769 172.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.31 43.34 1.01 Allowed 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 116.112 1.893 . . . . 0.0 116.112 173.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -117.7 -71.12 0.75 Allowed 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 102.281 -3.229 . . . . 0.0 102.281 171.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 34.7 m -84.89 81.04 9.06 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 103.437 -2.801 . . . . 0.0 103.437 167.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.7 mttm -66.76 5.92 0.56 Allowed 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 120.164 3.394 . . . . 0.0 120.164 -169.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.6 p -73.22 -72.93 0.23 Allowed 'General case' 0 CA--C 1.572 1.792 0 CA-C-O 118.613 -0.708 . . . . 0.0 109.14 171.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -166.68 14.44 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 115.981 1.845 . . . . 0.0 115.981 174.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 42.7 t -153.83 94.3 1.75 Allowed 'General case' 0 N--CA 1.499 2.019 0 CA-C-N 123.874 3.034 . . . . 0.0 117.973 -171.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 50.8 t -94.65 105.21 17.15 Favored 'General case' 0 CA--C 1.563 1.447 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 170.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.54 130.95 45.11 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 123.141 1.448 . . . . 0.0 112.824 -173.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 35.5 t60 -81.9 159.48 23.65 Favored 'General case' 0 CA--C 1.564 1.505 0 CA-C-O 122.815 1.293 . . . . 0.0 114.145 -174.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.3 p-10 -79.92 -51.42 9.12 Favored 'General case' 0 CA--C 1.57 1.717 0 CA-C-O 118.47 -0.776 . . . . 0.0 112.287 173.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -177.95 -65.37 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 124.589 1.156 . . . . 0.0 110.693 173.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 38.2 mm -133.01 -61.37 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 CA-C-N 121.042 1.746 . . . . 0.0 109.578 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.0 tp -71.06 102.4 2.45 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 120.192 1.36 . . . . 0.0 110.519 176.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 60.5 p -53.34 92.12 0.01 OUTLIER 'General case' 0 CA--C 1.573 1.856 1 N-CA-C 122.168 4.136 . . . . 0.0 122.168 -171.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 tt -125.5 87.03 2.63 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 101.865 -3.383 . . . . 0.0 101.865 171.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.7 m -99.98 136.39 39.96 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 -171.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -121.76 141.58 51.05 Favored 'General case' 0 CA--C 1.565 1.557 0 CA-C-N 114.707 -1.133 . . . . 0.0 108.347 174.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.7 m -79.55 146.31 32.69 Favored 'General case' 0 CA--C 1.556 1.174 0 O-C-N 119.492 -2.005 . . . . 0.0 113.831 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -135.64 -178.21 5.02 Favored 'General case' 0 CA--C 1.566 1.572 0 CA-C-N 113.841 -1.527 . . . . 0.0 113.996 -173.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.48 135.45 33.34 Favored 'General case' 0 CA--C 1.571 1.77 0 O-C-N 121.252 -0.905 . . . . 0.0 110.177 176.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.43 160.36 27.61 Favored 'General case' 0 CA--C 1.579 2.06 0 O-C-N 120.908 -1.12 . . . . 0.0 113.236 176.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.41 155.25 36.56 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 117.069 2.248 . . . . 0.0 117.069 -173.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 -117.18 175.77 5.45 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-N 112.889 -1.959 . . . . 0.0 110.696 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -58.38 128.1 35.45 Favored 'General case' 0 CA--C 1.57 1.748 0 O-C-N 120.651 -1.28 . . . . 0.0 113.631 -174.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 82.5 11.06 0.61 Allowed 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 125.748 1.619 . . . . 0.0 114.217 -173.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.7 t -110.36 147.16 34.5 Favored 'General case' 0 CA--C 1.563 1.458 0 O-C-N 120.143 -1.598 . . . . 0.0 111.988 175.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -80.11 110.56 15.63 Favored 'General case' 0 CA--C 1.57 1.734 0 CA-C-O 123.114 1.435 . . . . 0.0 112.449 -177.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.2 152.29 20.06 Favored 'General case' 0 CA--C 1.563 1.456 0 C-N-CA 125.926 1.69 . . . . 0.0 112.464 174.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.5 t -79.46 103.08 9.13 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 171.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.96 -38.51 69.76 Favored 'General case' 0 CA--C 1.566 1.562 0 N-CA-C 118.413 2.745 . . . . 0.0 118.413 -171.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.4 p90 -80.94 61.38 4.52 Favored 'General case' 0 CA--C 1.571 1.779 0 C-N-CA 124.728 1.211 . . . . 0.0 113.132 175.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.9 p -68.95 135.26 50.69 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 119.005 -2.309 . . . . 0.0 112.581 -174.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.307 0.5 OUTLIER -94.87 -135.32 0.2 Allowed 'General case' 0 CA--C 1.565 1.556 0 CA-C-N 111.551 -2.568 . . . . 0.0 107.272 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -139.45 73.57 1.44 Allowed 'General case' 0 CA--C 1.561 1.38 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 169.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -172.98 -140.6 3.2 Favored Glycine 0 N--CA 1.482 1.756 0 CA-C-N 115.3 -0.864 . . . . 0.0 113.333 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.4 t -87.56 142.98 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 CA-C-O 122.89 1.329 . . . . 0.0 111.139 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -117.85 132.66 56.41 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-O 122.515 1.15 . . . . 0.0 110.353 -174.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -62.21 -43.68 98.28 Favored 'General case' 0 CA--C 1.581 2.148 0 CA-C-N 115.604 -0.725 . . . . 0.0 112.913 174.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -137.1 110.91 8.15 Favored 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 103.46 -2.793 . . . . 0.0 103.46 172.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 51.3 m -51.4 152.68 4.26 Favored Pre-proline 0 CA--C 1.593 2.605 0 N-CA-C 116.911 2.189 . . . . 0.0 116.911 -176.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.62 -173.8 0.4 Allowed 'Trans proline' 0 CA--C 1.572 2.407 0 C-N-CA 122.851 2.368 . . . . 0.0 116.619 -174.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 70.2 m -80.08 155.62 27.45 Favored 'General case' 0 CA--C 1.573 1.834 0 O-C-N 120.427 -1.42 . . . . 0.0 113.56 -178.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.86 -178.8 2.0 Favored 'General case' 0 CA--C 1.578 2.055 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 -175.394 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.95 112.46 3.31 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.364 -1.46 . . . . 0.0 112.562 -175.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 86.55 29.26 24.77 Favored Glycine 0 CA--C 1.556 2.637 0 N-CA-C 117.435 1.734 . . . . 0.0 117.435 -173.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.9 tp -141.11 141.35 34.21 Favored 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 118.812 1.306 . . . . 0.0 111.083 -176.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.74 158.32 16.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.674 -1.266 . . . . 0.0 113.219 -176.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 4.3 t -91.09 95.35 10.04 Favored 'General case' 0 CA--C 1.575 1.933 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 173.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -97.63 -55.8 2.71 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 118.561 2.8 . . . . 0.0 118.561 -171.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -78.97 68.28 3.1 Favored Glycine 0 N--CA 1.497 2.728 0 N-CA-C 116.942 1.537 . . . . 0.0 116.942 -173.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -72.94 105.65 4.52 Favored 'General case' 0 CA--C 1.565 1.552 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -170.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -87.06 67.56 9.77 Favored 'General case' 0 CA--C 1.573 1.864 0 C-N-CA 123.883 0.873 . . . . 0.0 109.216 174.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 89.0 p -138.61 81.32 1.84 Allowed 'General case' 0 CA--C 1.561 1.377 0 O-C-N 121.274 -0.891 . . . . 0.0 111.963 -173.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.7 mp -97.46 74.25 2.45 Favored 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 174.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . 0.389 2.9 p 57.58 -54.45 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 N-CA-C 117.82 2.526 . . . . 0.0 117.82 -174.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -151.4 64.73 0.37 Allowed Glycine 0 N--CA 1.487 2.089 0 C-N-CA 124.244 0.926 . . . . 0.0 111.795 173.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 96.9 p -84.88 74.72 10.45 Favored 'General case' 0 CA--C 1.568 1.671 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 -171.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 21.7 mm 68.31 114.5 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.141 0 C-N-CA 125.685 1.594 . . . . 0.0 111.505 178.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.8 p 57.25 -176.79 0.06 Allowed 'General case' 0 N--CA 1.505 2.275 0 CA-C-O 123.433 1.587 . . . . 0.0 114.512 178.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -64.96 3.26 0.59 Allowed 'General case' 0 CA--C 1.587 2.391 0 N-CA-C 117.604 2.446 . . . . 0.0 117.604 172.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 75.0 p -98.79 74.03 2.04 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 124.458 2.075 . . . . 0.0 112.666 -174.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -108.83 71.56 0.78 Allowed 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 111.91 -2.404 . . . . 0.0 107.082 173.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -126.33 167.75 15.08 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 124.059 0.944 . . . . 0.0 113.443 -171.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -125.01 160.46 19.63 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 118.184 2.034 . . . . 0.0 118.184 -177.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.5 mm -91.96 129.57 42.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 O-C-N 120.989 -1.301 . . . . 0.0 109.675 -172.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.6 m -64.04 124.52 21.81 Favored 'General case' 0 CA--C 1.567 1.618 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 177.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 72.8 m-70 -143.8 161.37 38.8 Favored 'General case' 0 CA--C 1.565 1.55 0 CA-C-O 123.462 1.601 . . . . 0.0 111.988 175.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -98.08 131.47 44.45 Favored 'General case' 0 CA--C 1.563 1.448 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.145 175.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.7 t -105.61 71.08 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.039 0 CA-C-O 123.068 1.413 . . . . 0.0 108.566 -179.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -89.06 68.84 2.71 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 115.542 0.977 . . . . 0.0 115.542 -176.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 16.8 ptm180 -70.67 -37.94 73.71 Favored 'General case' 0 CA--C 1.574 1.899 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 -177.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 41.7 t . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 123.98 1.848 . . . . 0.0 114.298 -176.547 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 63.4 t . . . . . 0 CA--C 1.578 2.041 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -67.86 -16.74 46.29 Favored 'Trans proline' 0 CA--C 1.573 2.445 0 N-CA-C 120.208 3.118 . . . . 0.0 120.208 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -104.68 138.2 19.44 Favored Pre-proline 0 CA--C 1.582 2.18 0 CA-C-O 117.973 -1.013 . . . . 0.0 112.418 -178.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.41 68.6 7.95 Favored 'Trans proline' 0 CA--C 1.575 2.525 0 C-N-CA 122.524 2.15 . . . . 0.0 116.131 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 42.9 tpt85 -99.16 83.79 2.93 Favored 'General case' 0 CA--C 1.565 1.544 0 O-C-N 120.863 -1.148 . . . . 0.0 108.984 175.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 92.19 -56.02 2.84 Favored Glycine 0 N--CA 1.499 2.859 0 N-CA-C 115.339 0.896 . . . . 0.0 115.339 -174.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 10.4 tt -68.25 93.34 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.574 1.896 0 C-N-CA 125.693 1.597 . . . . 0.0 111.014 169.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 60.2 mt -70.3 98.99 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.282 0 CA-C-O 122.249 1.023 . . . . 0.0 110.551 -174.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 22.6 pt -116.91 -176.32 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.579 2.077 0 C-N-CA 124.325 1.05 . . . . 0.0 111.675 -177.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.25 62.5 m-80 100.06 97.42 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 C-N-CA 127.516 2.326 . . . . 0.0 110.297 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -139.98 158.15 44.53 Favored 'General case' 0 CA--C 1.573 1.841 0 CA-C-O 122.771 1.272 . . . . 0.0 110.987 173.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -79.69 162.13 25.39 Favored 'General case' 0 CA--C 1.566 1.588 0 N-CA-C 115.237 1.569 . . . . 0.0 115.237 -173.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -78.18 126.51 30.91 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-O 122.403 1.097 . . . . 0.0 109.741 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 114.91 19.09 6.12 Favored Glycine 0 CA--C 1.559 2.79 0 N-CA-C 116.019 1.168 . . . . 0.0 116.019 -172.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -135.08 149.97 50.16 Favored 'General case' 0 CA--C 1.569 1.693 0 CA-C-N 119.215 1.507 . . . . 0.0 111.181 -178.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mp -73.48 147.21 44.31 Favored 'General case' 0 CA--C 1.575 1.926 0 N-CA-C 114.093 1.146 . . . . 0.0 114.093 -178.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 4.0 p -135.73 -175.08 3.84 Favored 'General case' 0 CA--C 1.574 1.901 0 CA-C-O 122.767 1.27 . . . . 0.0 114.234 -174.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.5 mt -109.31 -76.96 0.6 Allowed 'General case' 0 CA--C 1.575 1.921 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 170.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.2 p30 -96.1 -178.43 4.33 Favored 'General case' 0 CA--C 1.584 2.267 0 N-CA-C 114.908 1.448 . . . . 0.0 114.908 172.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 t -85.42 -17.54 36.3 Favored 'General case' 0 N--CA 1.503 2.206 0 N-CA-C 117.358 2.355 . . . . 0.0 117.358 174.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.14 9.75 2.35 Favored 'General case' 0 CA--C 1.577 1.998 0 N-CA-C 116.771 2.138 . . . . 0.0 116.771 174.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -97.0 -31.44 12.52 Favored 'General case' 0 CA--C 1.567 1.611 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.7 m -68.7 170.48 9.31 Favored 'General case' 0 CA--C 1.581 2.171 0 CA-C-N 121.232 1.833 . . . . 0.0 113.586 174.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -65.85 -65.25 0.7 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.034 -1.666 . . . . 0.0 108.751 172.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 83.4 p -83.65 107.49 16.13 Favored 'General case' 0 CA--C 1.566 1.588 0 N-CA-C 102.866 -3.013 . . . . 0.0 102.866 168.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -66.15 79.29 0.09 Allowed 'General case' 0 N--CA 1.501 2.089 0 CA-C-O 124.746 2.212 . . . . 0.0 115.596 -171.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 36.4 t -143.19 89.77 2.13 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 112.083 -2.326 . . . . 0.0 111.22 174.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.2 t -86.78 114.57 23.56 Favored 'General case' 0 CA--C 1.555 1.163 0 N-CA-C 102.688 -3.079 . . . . 0.0 102.688 169.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -96.97 123.65 40.74 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-O 123.525 1.631 . . . . 0.0 112.34 -171.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -83.18 141.85 31.62 Favored 'General case' 0 CA--C 1.558 1.286 0 CA-C-N 114.079 -1.419 . . . . 0.0 113.865 -174.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -68.51 17.26 0.04 OUTLIER 'General case' 0 CA--C 1.586 2.353 0 N-CA-C 117.46 2.393 . . . . 0.0 117.46 172.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.263 42.8 p 65.54 65.99 0.54 Allowed 'General case' 0 N--CA 1.499 2.023 0 C-N-CA 126.103 1.761 . . . . 0.0 112.866 -177.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.336 13.4 mt 78.62 151.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.511 2.597 0 C-N-CA 125.188 1.395 . . . . 0.0 110.256 -179.1 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.8 tp 66.46 75.4 0.33 Allowed 'General case' 0 N--CA 1.51 2.571 0 O-C-N 120.197 -1.564 . . . . 0.0 108.587 -172.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.0 p -48.11 100.56 0.02 OUTLIER 'General case' 0 CA--C 1.574 1.885 1 N-CA-C 123.457 4.614 . . . . 0.0 123.457 -170.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 30.6 tp -132.42 82.79 2.03 Favored 'General case' 0 CA--C 1.572 1.79 0 N-CA-C 101.645 -3.465 . . . . 0.0 101.645 170.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.0 m -99.85 131.72 45.65 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 -171.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -135.48 136.12 41.02 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 123.976 0.91 . . . . 0.0 110.981 -174.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 60.6 m -63.25 136.64 57.83 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 119.873 -1.767 . . . . 0.0 112.985 176.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.86 179.78 6.66 Favored 'General case' 0 CA--C 1.565 1.533 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -173.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -76.45 164.44 25.98 Favored 'General case' 0 CA--C 1.571 1.759 0 CA-C-O 122.417 1.103 . . . . 0.0 113.962 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.91 163.14 28.59 Favored 'General case' 0 CA--C 1.567 1.612 0 N-CA-C 115.078 1.51 . . . . 0.0 115.078 179.039 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.03 142.84 32.98 Favored 'General case' 0 CA--C 1.564 1.489 0 CA-C-O 123.822 1.772 . . . . 0.0 113.434 177.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -96.65 164.14 12.71 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-N 113.739 -1.573 . . . . 0.0 112.173 -174.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -53.98 123.97 14.14 Favored 'General case' 0 CA--C 1.571 1.772 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -174.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 84.6 18.77 0.15 Allowed 'General case' 0 N--CA 1.508 2.444 0 C-N-CA 126.056 1.742 . . . . 0.0 113.949 -172.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.9 t -119.95 150.82 39.89 Favored 'General case' 0 CA--C 1.566 1.591 0 O-C-N 120.203 -1.56 . . . . 0.0 112.211 174.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -67.13 141.14 57.51 Favored 'General case' 0 CA--C 1.57 1.738 0 CA-C-O 122.886 1.327 . . . . 0.0 114.315 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -129.44 139.09 51.74 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-N 113.861 -1.518 . . . . 0.0 112.811 -176.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.8 t -87.82 85.56 7.05 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-O 122.171 0.986 . . . . 0.0 109.981 174.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.48 -33.05 64.63 Favored 'General case' 0 CA--C 1.571 1.752 0 N-CA-C 119.479 3.14 . . . . 0.0 119.479 -173.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -78.8 153.93 30.31 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 125.502 1.521 . . . . 0.0 112.915 174.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.1 p -112.44 125.4 54.17 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 123.338 1.542 . . . . 0.0 109.8 172.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -99.64 -159.41 0.74 Allowed 'General case' 0 CA--C 1.576 1.972 0 CA-C-N 112.655 -2.066 . . . . 0.0 106.738 171.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -112.49 64.42 0.63 Allowed 'General case' 0 N--CA 1.5 2.049 0 O-C-N 119.634 -1.916 . . . . 0.0 106.109 171.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 178.89 -165.83 35.1 Favored Glycine 0 CA--C 1.542 1.757 0 CA-C-N 113.724 -1.58 . . . . 0.0 114.872 -173.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.4 t -92.87 156.23 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 CA-C-O 123.314 1.531 . . . . 0.0 113.171 -166.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 17.6 m-30 -106.44 140.76 38.84 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 114.797 -1.092 . . . . 0.0 113.742 -176.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -71.58 -59.16 2.9 Favored 'General case' 0 CA--C 1.575 1.911 0 O-C-N 121.23 -0.919 . . . . 0.0 113.051 175.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.96 119.62 30.95 Favored 'General case' 0 CA--C 1.567 1.621 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 174.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 55.1 m -49.46 153.34 1.92 Allowed Pre-proline 0 CA--C 1.588 2.432 0 N-CA-C 120.064 3.357 . . . . 0.0 120.064 -177.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -58.23 169.47 2.9 Favored 'Trans proline' 0 CA--C 1.573 2.453 0 C-N-CA 123.216 2.611 . . . . 0.0 115.573 172.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 2.7 m -94.02 107.16 19.1 Favored 'General case' 0 CA--C 1.577 1.985 0 O-C-N 120.397 -1.439 . . . . 0.0 109.19 175.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.401 0.0 OUTLIER -83.86 -63.16 1.4 Allowed 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 120.961 3.689 . . . . 0.0 120.961 -171.32 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.89 82.11 7.65 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.245 -1.535 . . . . 0.0 114.957 -173.229 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 71.24 33.26 64.85 Favored Glycine 0 N--CA 1.495 2.616 0 N-CA-C 119.339 2.495 . . . . 0.0 119.339 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.4 mp -122.33 143.98 49.29 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 122.51 1.147 . . . . 0.0 111.464 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.63 155.82 17.86 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 122.227 1.013 . . . . 0.0 112.55 177.325 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 3.5 t -94.88 86.99 4.83 Favored 'General case' 0 CA--C 1.575 1.941 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.421 175.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -96.42 110.58 22.91 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.514 -1.366 . . . . 0.0 112.98 -173.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 142.95 75.4 0.03 OUTLIER Glycine 0 N--CA 1.493 2.445 0 O-C-N 121.284 -0.885 . . . . 0.0 112.954 175.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.25 -10.31 0.03 OUTLIER 'General case' 0 CA--C 1.583 2.239 0 N-CA-C 119.785 3.254 . . . . 0.0 119.785 -178.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 62.55 -100.46 0.09 Allowed 'General case' 0 N--CA 1.501 2.095 0 CA-C-N 121.353 1.888 . . . . 0.0 109.026 -173.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 94.4 p -135.92 12.75 3.38 Favored 'General case' 0 CA--C 1.574 1.901 0 N-CA-C 115.954 1.835 . . . . 0.0 115.954 174.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.2 pp -66.79 -31.12 71.55 Favored 'General case' 0 N--CA 1.5 2.065 0 N-CA-C 117.067 2.247 . . . . 0.0 117.067 -176.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.7 p -83.83 74.53 0.98 Allowed 'Isoleucine or valine' 0 CA--C 1.577 2.005 0 CA-C-O 123.516 1.627 . . . . 0.0 110.098 174.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -163.11 88.75 0.1 Allowed Glycine 0 N--CA 1.484 1.885 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.692 -174.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.2 m -70.42 123.25 21.3 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 178.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.258 17.1 mt 78.91 -77.14 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 C-N-CA 124.921 1.288 . . . . 0.0 108.136 -174.568 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 3.1 p -91.91 134.32 34.89 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 122.793 1.282 . . . . 0.0 112.626 174.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.75 76.76 7.64 Favored 'General case' 0 CA--C 1.571 1.77 0 CA-C-O 122.896 1.332 . . . . 0.0 109.401 173.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.2 m -96.68 -14.28 22.19 Favored 'General case' 0 CA--C 1.573 1.84 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -173.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -75.05 147.2 40.87 Favored 'General case' 0 CA--C 1.57 1.734 0 CA-C-O 122.463 1.125 . . . . 0.0 110.314 173.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -131.45 149.39 52.55 Favored 'General case' 0 CA--C 1.57 1.745 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.376 179.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -89.95 155.24 24.42 Favored Glycine 0 N--CA 1.499 2.867 0 O-C-N 120.922 -1.111 . . . . 0.0 114.614 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 29.5 mm -94.45 130.83 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 120.232 -1.746 . . . . 0.0 110.931 -170.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 95.8 m -61.11 120.53 10.48 Favored 'General case' 0 CA--C 1.566 1.576 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 175.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -144.52 143.54 30.9 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 122.481 1.134 . . . . 0.0 110.617 174.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -95.67 77.32 3.28 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 124.279 1.99 . . . . 0.0 111.792 -174.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.9 m -69.41 -15.27 19.36 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.991 0 N-CA-C 117.161 2.282 . . . . 0.0 117.161 -177.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -77.61 -37.48 30.57 Favored Glycine 0 CA--C 1.552 2.4 0 N-CA-C 117.782 1.873 . . . . 0.0 117.782 174.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 35.1 ptt180 -141.49 -56.72 0.48 Allowed 'General case' 0 CA--C 1.574 1.875 0 CA-C-N 119.338 1.569 . . . . 0.0 113.765 178.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 124.043 1.878 . . . . 0.0 114.007 -174.405 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 95.3 t . . . . . 0 CA--C 1.578 2.039 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -81.2 74.96 5.23 Favored 'Trans proline' 0 CA--C 1.571 2.365 0 C-N-CA 122.356 2.038 . . . . 0.0 114.537 -179.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -102.9 109.28 60.98 Favored Pre-proline 0 CA--C 1.577 2.007 0 CA-C-O 117.88 -1.057 . . . . 0.0 111.069 -178.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -72.22 -11.46 26.93 Favored 'Trans proline' 0 CA--C 1.575 2.546 0 N-CA-C 118.403 2.424 . . . . 0.0 118.403 175.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 84.5 mtm180 72.13 -53.72 0.69 Allowed 'General case' 0 N--CA 1.503 2.213 0 C-N-CA 126.112 1.765 . . . . 0.0 115.671 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 97.51 56.2 1.12 Allowed Glycine 0 N--CA 1.493 2.445 0 N-CA-C 116.037 1.175 . . . . 0.0 116.037 -174.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 10.2 tp -82.48 74.43 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.574 1.885 0 C-N-CA 124.631 1.172 . . . . 0.0 111.916 -178.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 38.9 mm 80.18 138.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.389 0 C-N-CA 125.546 1.538 . . . . 0.0 109.5 -174.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 20.1 pt -92.63 144.29 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 CA-C-O 123.013 1.387 . . . . 0.0 111.355 -177.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 -148.29 106.22 3.71 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.285 -177.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.2 tp -154.05 118.63 4.91 Favored 'General case' 0 CA--C 1.574 1.895 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 175.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -74.04 164.82 26.14 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -173.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 mp0 -69.86 132.84 46.64 Favored 'General case' 0 CA--C 1.567 1.604 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.891 -174.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.04 -10.29 51.46 Favored Glycine 0 N--CA 1.497 2.703 0 N-CA-C 117.18 1.632 . . . . 0.0 117.18 -173.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -99.23 144.11 28.73 Favored 'General case' 0 CA--C 1.566 1.569 0 CA-C-N 118.983 1.392 . . . . 0.0 110.843 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.5 mp -67.29 136.21 54.53 Favored 'General case' 0 CA--C 1.575 1.915 0 N-CA-C 113.904 1.075 . . . . 0.0 113.904 -175.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 11.7 p -137.92 144.57 41.34 Favored 'General case' 0 CA--C 1.565 1.522 0 C-N-CA 124.034 0.934 . . . . 0.0 112.122 -177.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 78.1 mt -82.99 -66.1 0.93 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.253 -0.904 . . . . 0.0 112.155 176.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -98.76 165.33 11.84 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 120.002 1.274 . . . . 0.0 113.198 174.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -74.92 -13.4 60.53 Favored 'General case' 0 N--CA 1.506 2.371 0 N-CA-C 116.301 1.963 . . . . 0.0 116.301 172.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.55 30.79 0.41 Allowed 'General case' 0 CA--C 1.58 2.098 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 172.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -127.95 -23.76 3.3 Favored 'General case' 0 CA--C 1.571 1.751 0 CA-C-O 116.767 -1.587 . . . . 0.0 114.863 -175.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 57.0 m -73.31 -144.99 0.02 OUTLIER 'General case' 0 CA--C 1.587 2.402 0 CA-C-N 122.23 2.287 . . . . 0.0 113.254 176.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -83.57 -67.64 0.77 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 118.759 -2.463 . . . . 0.0 114.233 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 61.9 p -84.66 -74.21 0.4 Allowed 'General case' 0 CA--C 1.566 1.584 0 O-C-N 121.248 -0.908 . . . . 0.0 111.235 174.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.5 t-20 -172.76 77.8 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 C-N-CA 124.731 1.212 . . . . 0.0 109.521 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.8 t -160.29 98.04 1.26 Allowed 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 121.259 1.845 . . . . 0.0 115.798 173.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.8 t -101.11 117.43 34.99 Favored 'General case' 0 CA--C 1.562 1.405 0 N-CA-C 103.046 -2.946 . . . . 0.0 103.046 169.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 65.1 tp60 -94.94 113.09 24.76 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.363 1.065 . . . . 0.0 113.739 -173.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -81.85 135.01 35.46 Favored 'General case' 0 CA--C 1.56 1.361 0 CA-C-N 114.741 -1.118 . . . . 0.0 111.119 176.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.4 p-10 -73.09 -75.53 0.14 Allowed 'General case' 0 CA--C 1.574 1.885 0 CA-C-O 118.326 -0.845 . . . . 0.0 113.043 174.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.5 t -169.5 92.6 0.25 Allowed 'General case' 0 N--CA 1.502 2.142 0 CA-C-N 120.906 1.685 . . . . 0.0 111.51 -177.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.305 3.8 mp 70.65 -69.06 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 C-N-CA 125.427 1.491 . . . . 0.0 111.348 174.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.4 mp -69.08 109.56 4.07 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 120.304 1.411 . . . . 0.0 107.697 173.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 56.7 p -72.2 83.57 1.02 Allowed 'General case' 0 CA--C 1.567 1.617 0 N-CA-C 120.502 3.519 . . . . 0.0 120.502 -171.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.7 tp -104.99 81.13 1.7 Allowed 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 103.305 -2.85 . . . . 0.0 103.305 170.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 26.9 m -100.58 124.17 45.79 Favored 'General case' 0 CA--C 1.564 1.495 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -170.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 65.6 mtt85 -114.33 167.85 10.35 Favored 'General case' 0 N--CA 1.501 2.102 0 C-N-CA 124.05 0.94 . . . . 0.0 111.601 174.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 83.4 m -79.95 147.86 31.44 Favored 'General case' 0 CA--C 1.568 1.649 0 O-C-N 118.565 -2.584 . . . . 0.0 111.104 172.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.91 172.43 12.7 Favored 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 -174.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.1 mt -85.25 152.67 23.14 Favored 'General case' 0 CA--C 1.568 1.663 0 CA-C-O 122.2 1.0 . . . . 0.0 113.034 -178.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -64.88 146.31 55.08 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 178.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.91 155.11 33.05 Favored 'General case' 0 CA--C 1.564 1.504 0 CA-C-O 123.398 1.571 . . . . 0.0 114.848 -175.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -108.33 172.66 6.71 Favored 'General case' 0 CA--C 1.562 1.422 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.448 -174.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -52.7 126.72 20.78 Favored 'General case' 0 CA--C 1.572 1.814 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 -174.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 74.51 20.11 2.55 Favored 'General case' 0 N--CA 1.506 2.347 0 N-CA-C 114.858 1.429 . . . . 0.0 114.858 -173.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 37.3 t -115.41 153.37 31.18 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 120.524 -1.36 . . . . 0.0 111.188 174.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -64.46 136.92 57.55 Favored 'General case' 0 CA--C 1.57 1.722 0 CA-C-O 123.18 1.467 . . . . 0.0 113.017 176.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 17.0 p -138.19 139.96 39.56 Favored 'General case' 0 CA--C 1.559 1.312 0 CA-C-N 113.194 -1.821 . . . . 0.0 112.436 -176.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.1 t -75.14 90.39 2.53 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 122.991 1.377 . . . . 0.0 110.704 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -76.56 -51.04 12.41 Favored 'General case' 0 CA--C 1.568 1.65 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 -173.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 54.0 p90 -79.25 -37.26 38.38 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 117.193 2.294 . . . . 0.0 117.193 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 80.4 p 62.84 144.04 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 127.034 2.134 . . . . 0.0 114.644 -174.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.23 -168.36 1.55 Allowed 'General case' 0 CA--C 1.567 1.632 0 CA-C-N 113.934 -1.485 . . . . 0.0 108.436 171.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -103.42 74.3 1.26 Allowed 'General case' 0 CA--C 1.567 1.62 0 N-CA-C 105.191 -2.152 . . . . 0.0 105.191 171.049 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 166.42 -160.18 33.68 Favored Glycine 0 N--CA 1.482 1.701 0 CA-C-O 122.388 0.993 . . . . 0.0 115.079 -174.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 13.3 t -83.91 143.98 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 CA-C-O 122.935 1.35 . . . . 0.0 112.32 -167.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -109.24 135.18 50.76 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.916 -174.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -74.51 -17.58 60.73 Favored 'General case' 0 CA--C 1.589 2.447 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 173.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm -147.67 119.21 7.94 Favored 'General case' 0 CA--C 1.572 1.817 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 174.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 74.4 m -55.51 151.11 21.79 Favored Pre-proline 0 CA--C 1.586 2.357 0 N-CA-C 117.366 2.358 . . . . 0.0 117.366 177.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -66.79 172.88 8.89 Favored 'Trans proline' 0 CA--C 1.576 2.61 0 C-N-CA 122.464 2.109 . . . . 0.0 115.623 174.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 34.1 m -74.7 154.67 38.34 Favored 'General case' 0 CA--C 1.579 2.065 0 O-C-N 120.63 -1.294 . . . . 0.0 114.481 -178.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.41 179.15 7.85 Favored 'General case' 0 CA--C 1.576 1.957 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 179.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -65.81 103.44 0.9 Allowed 'General case' 0 CA--C 1.572 1.813 0 O-C-N 120.49 -1.381 . . . . 0.0 113.02 -176.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 129.79 -45.68 1.12 Allowed Glycine 0 N--CA 1.494 2.559 0 CA-C-N 115.224 -0.898 . . . . 0.0 114.816 -173.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mp -93.75 139.44 30.84 Favored 'General case' 0 CA--C 1.562 1.411 0 CA-C-O 122.707 1.242 . . . . 0.0 111.338 -176.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.32 151.24 21.28 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 121.787 0.803 . . . . 0.0 112.414 -177.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.8 t -92.13 124.36 36.16 Favored 'General case' 0 CA--C 1.567 1.621 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.527 173.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -92.68 96.78 10.38 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.702 -1.249 . . . . 0.0 107.672 -176.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.01 39.41 0.09 OUTLIER Glycine 0 N--CA 1.497 2.741 1 N-CA-C 124.6 4.6 . . . . 0.0 124.6 -172.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -88.51 101.45 13.94 Favored 'General case' 0 CA--C 1.567 1.617 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 161.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -67.69 90.28 0.27 Allowed 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 -173.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.1 p 45.26 43.32 8.02 Favored 'General case' 0 CA--C 1.576 1.943 0 N-CA-C 118.208 2.67 . . . . 0.0 118.208 -178.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.8 mt -72.55 -27.02 61.96 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 116.044 1.868 . . . . 0.0 116.044 -175.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 67.0 t -74.41 -27.14 20.98 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.24 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 174.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -150.01 76.04 0.25 Allowed Glycine 0 N--CA 1.49 2.286 0 CA-C-N 119.815 1.188 . . . . 0.0 114.624 177.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 86.8 p -85.09 91.11 8.02 Favored 'General case' 0 CA--C 1.57 1.727 0 CA-C-O 121.378 0.609 . . . . 0.0 112.388 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 19.9 tt -137.02 -69.23 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 C-N-CA 123.676 0.79 . . . . 0.0 110.17 -178.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 26.5 p -70.47 163.56 26.54 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 120.886 -1.134 . . . . 0.0 112.417 174.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -76.6 59.41 1.51 Allowed 'General case' 0 CA--C 1.581 2.165 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 -178.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 41.6 p -139.08 75.2 1.5 Allowed 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 123.83 1.776 . . . . 0.0 110.119 -178.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 19.7 p-10 -84.6 77.38 10.05 Favored 'General case' 0 N--CA 1.496 1.834 0 CA-C-N 113.365 -1.743 . . . . 0.0 111.122 178.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -134.79 160.09 39.3 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 -172.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.12 -179.26 52.53 Favored Glycine 0 N--CA 1.493 2.454 0 O-C-N 121.786 -0.571 . . . . 0.0 113.677 172.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.0 mm -115.59 137.08 50.35 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.536 0 CA-C-N 119.455 1.627 . . . . 0.0 111.62 -174.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.0 m -69.56 126.83 30.92 Favored 'General case' 0 CA--C 1.569 1.696 0 O-C-N 120.813 -1.179 . . . . 0.0 114.179 174.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -141.33 156.05 45.88 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 122.905 1.336 . . . . 0.0 111.115 176.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -93.68 77.11 4.31 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-O 124.097 1.903 . . . . 0.0 111.629 -174.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 93.0 t -118.63 -70.3 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 CA-C-N 112.246 -2.252 . . . . 0.0 109.04 -177.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.79 96.15 0.1 Allowed Glycine 0 N--CA 1.48 1.608 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -177.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -41.72 -39.29 1.66 Allowed 'General case' 0 N--CA 1.504 2.226 0 N-CA-C 120.005 3.335 . . . . 0.0 120.005 -175.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 115.92 1.822 . . . . 0.0 115.92 178.13 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 95.9 t . . . . . 0 CA--C 1.583 2.248 0 CA-C-O 115.409 -2.234 . . . . 0.0 112.187 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -70.21 95.33 0.59 Allowed 'Trans proline' 0 CA--C 1.57 2.312 0 CA-C-N 126.24 3.264 . . . . 0.0 115.497 -178.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -107.62 107.4 60.3 Favored Pre-proline 0 CA--C 1.577 2.014 0 CA-C-O 117.771 -1.109 . . . . 0.0 110.27 178.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -69.08 86.28 0.49 Allowed 'Trans proline' 0 CA--C 1.571 2.374 0 C-N-CA 122.834 2.356 . . . . 0.0 116.104 178.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -84.93 -48.86 8.87 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -177.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 147.52 -101.08 0.23 Allowed Glycine 0 N--CA 1.484 1.845 0 O-C-N 121.091 -1.005 . . . . 0.0 112.409 176.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 50.1 mm -125.56 89.82 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 -177.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 16.0 tt -89.99 50.9 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.477 0 CA-C-O 122.534 1.159 . . . . 0.0 112.948 174.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.298 40.5 mm -122.15 -93.35 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.575 1.929 0 N-CA-C 104.814 -2.291 . . . . 0.0 104.814 -175.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 35.06 87.79 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.15 0 N-CA-C 120.844 3.646 . . . . 0.0 120.844 172.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.4 tp -127.81 127.29 43.26 Favored 'General case' 0 CA--C 1.58 2.106 0 O-C-N 120.679 -1.263 . . . . 0.0 108.985 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -76.13 158.73 31.43 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 119.961 -1.712 . . . . 0.0 114.895 -174.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.26 136.22 54.59 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 122.028 0.918 . . . . 0.0 111.216 176.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.96 -7.85 67.56 Favored Glycine 0 CA--C 1.557 2.69 0 N-CA-C 116.558 1.383 . . . . 0.0 116.558 -172.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -97.66 142.72 29.12 Favored 'General case' 0 CA--C 1.567 1.599 0 CA-C-N 119.026 1.413 . . . . 0.0 110.167 178.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.4 mp -63.99 128.09 34.28 Favored 'General case' 0 CA--C 1.573 1.835 0 CA-C-O 122.14 0.971 . . . . 0.0 112.455 -178.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -129.11 157.85 40.6 Favored 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 123.741 1.734 . . . . 0.0 113.57 -173.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.3 mt -102.76 -64.97 1.02 Allowed 'General case' 0 CA--C 1.573 1.849 0 CA-C-N 114.269 -1.332 . . . . 0.0 107.598 170.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -98.97 148.83 23.59 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.8 t -68.29 -22.65 64.72 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 119.819 -1.801 . . . . 0.0 112.842 169.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . 0.3 . . -71.68 3.4 4.09 Favored 'General case' 0 CA--C 1.58 2.121 0 N-CA-C 115.725 1.75 . . . . 0.0 115.725 171.154 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -99.83 -37.52 9.03 Favored 'General case' 0 CA--C 1.575 1.928 0 C-N-CA 126.05 1.74 . . . . 0.0 113.206 173.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 12.5 m -76.46 157.37 32.27 Favored 'General case' 0 CA--C 1.572 1.795 0 N-CA-C 116.507 2.04 . . . . 0.0 116.507 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -68.54 -59.65 2.99 Favored 'General case' 0 N--CA 1.501 2.084 0 C-N-CA 124.307 1.043 . . . . 0.0 109.016 172.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.7 t -81.52 104.38 11.9 Favored 'General case' 0 CA--C 1.565 1.534 0 N-CA-C 103.0 -2.963 . . . . 0.0 103.0 168.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -70.88 82.01 0.65 Allowed 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 124.528 2.109 . . . . 0.0 113.071 -172.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 28.8 t -155.92 81.56 1.01 Allowed 'General case' 0 CA--C 1.56 1.336 0 CA-C-N 112.157 -2.292 . . . . 0.0 109.99 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.0 t -78.84 114.2 17.57 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 104.785 -2.302 . . . . 0.0 104.785 172.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.03 109.27 16.21 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -171.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -77.35 108.37 10.44 Favored 'General case' 0 CA--C 1.564 1.489 0 CA-C-O 122.244 1.021 . . . . 0.0 111.132 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.1 p-10 -64.82 42.71 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.341 0 N-CA-C 119.115 3.005 . . . . 0.0 119.115 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.8 p 67.17 84.22 0.16 Allowed 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 126.049 1.74 . . . . 0.0 113.725 173.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.273 4.3 mp 72.49 -48.56 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 C-N-CA 125.292 1.437 . . . . 0.0 113.63 177.099 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.8 mt -51.68 -27.47 11.79 Favored 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 118.33 2.715 . . . . 0.0 118.33 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.251 28.4 p 76.73 -2.6 2.66 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 118.988 2.958 . . . . 0.0 118.988 174.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.5 mp -73.95 95.01 2.41 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 121.041 1.746 . . . . 0.0 106.735 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.6 m -96.55 158.55 15.38 Favored 'General case' 0 CA--C 1.567 1.616 0 CA-C-O 122.874 1.321 . . . . 0.0 113.961 -170.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -141.55 138.39 32.65 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.675 -1.265 . . . . 0.0 110.922 -178.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 67.3 m -63.22 143.48 57.76 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 118.448 -2.658 . . . . 0.0 113.721 176.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.95 171.86 13.49 Favored 'General case' 0 CA--C 1.564 1.509 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -173.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -108.02 149.26 28.63 Favored 'General case' 0 CA--C 1.569 1.68 0 CA-C-N 114.481 -1.236 . . . . 0.0 110.793 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -53.38 142.59 21.24 Favored 'General case' 0 CA--C 1.577 2.007 0 N-CA-C 116.372 1.99 . . . . 0.0 116.372 176.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.4 168.79 19.43 Favored 'General case' 0 CA--C 1.574 1.882 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -174.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 63.1 mtt-85 -116.44 162.86 16.91 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.011 -1.056 . . . . 0.0 112.183 -177.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -55.4 126.76 26.48 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -175.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.265 66.9 m-80 77.76 20.82 1.01 Allowed 'General case' 0 CA--C 1.584 2.254 0 C-N-CA 125.267 1.427 . . . . 0.0 114.464 -173.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.0 t -119.51 155.15 32.68 Favored 'General case' 0 CA--C 1.565 1.529 0 O-C-N 120.477 -1.389 . . . . 0.0 110.742 173.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -61.93 130.01 43.64 Favored 'General case' 0 CA--C 1.566 1.568 0 CA-C-O 123.21 1.481 . . . . 0.0 114.479 -176.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.478 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 23.4 t -133.48 145.29 50.07 Favored 'General case' 0 CA--C 1.568 1.669 0 CA-C-N 113.022 -1.899 . . . . 0.0 112.752 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.5 m -120.57 137.65 54.29 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 105.245 -2.131 . . . . 0.0 105.245 171.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -82.07 -132.32 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.144 0 O-C-N 120.512 -1.368 . . . . 0.0 113.464 -174.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -133.15 156.25 47.8 Favored 'General case' 0 N--CA 1.491 1.584 1 N-CA-C 125.108 5.225 . . . . 0.0 125.108 -169.086 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.351 70.3 p 63.94 128.0 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.133 1 CA-C-N 108.115 -4.129 . . . . 0.0 115.165 -178.058 . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.346 0.4 OUTLIER -142.85 -81.08 0.2 Allowed 'General case' 0 CA--C 1.582 2.194 1 CA-C-N 108.228 -4.078 . . . . 0.0 100.683 -173.883 . . . . . . . . 4 3 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -159.22 -16.29 0.06 Allowed 'General case' 0 CA--C 1.611 3.312 0 C-N-CA 130.194 3.398 . . . . 0.0 107.907 169.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 118.0 58.48 0.28 Allowed Glycine 0 CA--C 1.562 2.982 0 C-N-CA 125.373 1.463 . . . . 0.0 113.773 -170.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.9 t -145.15 141.45 22.81 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.756 0 CA-C-N 121.791 2.796 . . . . 0.0 106.088 139.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -125.8 131.29 52.49 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 120.782 -1.198 . . . . 0.0 113.686 -172.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -69.1 -29.66 67.79 Favored 'General case' 0 CA--C 1.579 2.059 0 N-CA-C 116.133 1.901 . . . . 0.0 116.133 179.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -149.56 125.32 10.46 Favored 'General case' 0 CA--C 1.57 1.736 0 N-CA-C 105.823 -1.918 . . . . 0.0 105.823 174.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.2 m -55.23 152.19 16.15 Favored Pre-proline 0 CA--C 1.596 2.746 0 N-CA-C 116.797 2.147 . . . . 0.0 116.797 -175.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -78.45 37.48 0.64 Allowed 'Trans proline' 0 CA--C 1.569 2.271 1 N-CA-C 122.786 4.11 . . . . 0.0 122.786 -171.188 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.478 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 29.8 m 64.42 144.17 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 -178.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -66.24 145.94 55.19 Favored 'General case' 0 CA--C 1.569 1.677 0 O-C-N 119.816 -1.802 . . . . 0.0 112.961 176.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -62.97 119.76 10.06 Favored 'General case' 0 CA--C 1.565 1.538 0 CA-C-O 123.737 1.732 . . . . 0.0 114.628 -172.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 138.69 -48.76 0.86 Allowed Glycine 0 N--CA 1.49 2.299 0 CA-C-N 112.461 -2.154 . . . . 0.0 113.804 -172.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -105.08 173.69 6.2 Favored 'General case' 0 CA--C 1.575 1.915 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 175.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -100.64 155.1 18.07 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -173.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 37.3 t -96.36 127.8 42.69 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-N 113.324 -1.762 . . . . 0.0 110.895 172.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -97.75 151.36 20.24 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 120.728 1.604 . . . . 0.0 111.649 174.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -124.7 83.44 0.35 Allowed Glycine 0 N--CA 1.495 2.606 0 O-C-N 120.783 -1.198 . . . . 0.0 112.562 176.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -85.55 76.59 10.01 Favored 'General case' 0 CA--C 1.572 1.793 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 -170.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.85 71.17 0.5 Allowed 'General case' 0 N--CA 1.504 2.234 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 174.774 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 50.1 m -74.39 -51.37 15.2 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 114.843 1.423 . . . . 0.0 114.843 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.14 75.57 10.31 Favored 'General case' 0 CA--C 1.571 1.767 0 CA-C-N 119.558 1.072 . . . . 0.0 110.248 174.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . 0.322 14.8 p -103.58 -106.35 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.57 1.72 0 C-N-CA 124.009 0.924 . . . . 0.0 110.069 -176.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 179.9 82.72 0.06 OUTLIER Glycine 0 N--CA 1.488 2.165 0 O-C-N 120.699 -1.251 . . . . 0.0 115.331 179.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.9 t -134.88 -131.5 0.16 Allowed 'General case' 0 CA--C 1.575 1.909 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 172.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.269 0.0 OUTLIER -80.29 -65.39 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.226 0 O-C-N 120.234 -1.541 . . . . 0.0 108.527 173.431 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.4 p -116.46 135.1 54.12 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 122.895 1.331 . . . . 0.0 109.486 173.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 46.3 m-20 -82.43 65.68 7.68 Favored 'General case' 0 CA--C 1.573 1.858 0 CA-C-O 122.819 1.295 . . . . 0.0 113.512 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 40.6 p -125.1 75.98 1.5 Allowed 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 123.953 1.835 . . . . 0.0 109.508 177.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -123.73 98.18 5.7 Favored 'General case' 0 CA--C 1.566 1.558 0 CA-C-N 112.366 -2.197 . . . . 0.0 107.583 -177.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -107.76 161.0 15.29 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-O 122.039 0.923 . . . . 0.0 112.213 -173.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -86.76 -164.32 39.76 Favored Glycine 0 N--CA 1.487 2.046 0 O-C-N 121.071 -1.018 . . . . 0.0 115.457 175.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 33.9 mm -125.89 152.71 33.26 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.058 0 CA-C-O 122.882 1.325 . . . . 0.0 110.29 -174.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 58.6 m -76.11 122.09 23.77 Favored 'General case' 0 CA--C 1.57 1.722 0 O-C-N 120.312 -1.493 . . . . 0.0 112.379 172.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -138.51 143.01 39.34 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 123.414 1.578 . . . . 0.0 111.092 178.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 -98.93 137.14 37.91 Favored 'General case' 0 CA--C 1.56 1.355 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.578 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 57.9 t -110.96 -87.79 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.45 -174.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.57 84.86 0.36 Allowed Glycine 0 N--CA 1.493 2.46 0 N-CA-C 115.46 0.944 . . . . 0.0 115.46 -178.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.0 108.87 1.31 Allowed 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 117.8 0.8 . . . . 0.0 112.557 -176.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 62.2 p . . . . . 0 N--CA 1.489 1.518 0 CA-C-O 123.266 1.508 . . . . 0.0 110.497 -174.268 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 CA--C 1.577 2.005 0 CA-C-O 118.961 -0.542 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -73.51 53.32 2.63 Favored 'Trans proline' 0 CA--C 1.578 2.704 0 C-N-CA 122.712 2.275 . . . . 0.0 117.063 177.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -138.85 75.51 36.09 Favored Pre-proline 0 CA--C 1.579 2.061 0 O-C-N 120.441 -1.412 . . . . 0.0 112.683 -174.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -71.7 -65.09 0.03 OUTLIER 'Trans proline' 0 CA--C 1.571 2.33 0 C-N-CA 122.436 2.09 . . . . 0.0 113.878 176.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 42.0 ttp180 -99.83 75.7 1.91 Allowed 'General case' 0 CA--C 1.571 1.764 0 O-C-N 121.22 -0.925 . . . . 0.0 108.905 173.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.34 84.24 0.08 OUTLIER Glycine 0 N--CA 1.487 2.096 0 O-C-N 121.069 -1.02 . . . . 0.0 115.634 -176.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 5.1 mp -97.18 83.21 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 N-CA-C 105.679 -1.971 . . . . 0.0 105.679 171.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 21.3 pt -85.57 122.68 38.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 CA-C-O 122.338 1.066 . . . . 0.0 112.164 -174.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.9 pt -100.12 -174.52 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.582 2.204 0 C-N-CA 123.893 0.877 . . . . 0.0 111.65 177.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 94.95 86.98 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 127.382 2.273 . . . . 0.0 112.642 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -138.41 157.39 46.31 Favored 'General case' 0 CA--C 1.573 1.849 0 CA-C-O 122.664 1.221 . . . . 0.0 111.941 172.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -78.11 167.19 21.82 Favored 'General case' 0 CA--C 1.569 1.693 0 O-C-N 120.337 -1.477 . . . . 0.0 113.961 -175.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -74.82 148.32 40.38 Favored 'General case' 0 CA--C 1.578 2.02 0 CA-C-O 122.312 1.053 . . . . 0.0 110.762 174.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.52 28.2 10.74 Favored Glycine 0 CA--C 1.56 2.888 0 N-CA-C 114.979 0.752 . . . . 0.0 114.979 -171.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -139.39 146.22 39.91 Favored 'General case' 0 CA--C 1.568 1.636 0 C-N-CA 125.157 1.383 . . . . 0.0 109.698 -175.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.2 tt -69.68 119.18 13.52 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 120.657 -1.277 . . . . 0.0 111.721 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 14.6 p -120.92 158.42 27.72 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -175.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -88.64 -84.79 0.2 Allowed 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 174.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.7 p30 -94.03 169.78 10.02 Favored 'General case' 0 N--CA 1.499 2.004 0 C-N-CA 124.021 0.928 . . . . 0.0 113.11 173.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.7 m -72.03 -23.08 61.33 Favored 'General case' 0 N--CA 1.504 2.261 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 174.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.28 12.06 1.04 Allowed 'General case' 0 CA--C 1.583 2.245 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 173.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 31.3 mm100 -93.1 -47.56 6.91 Favored 'General case' 0 CA--C 1.569 1.702 0 C-N-CA 125.05 1.34 . . . . 0.0 112.737 174.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 70.9 m -72.55 154.28 40.88 Favored 'General case' 0 CA--C 1.57 1.75 0 CA-C-N 120.451 1.478 . . . . 0.0 113.705 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -54.44 -57.39 11.5 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.944 -1.097 . . . . 0.0 111.1 174.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.1 m -83.75 106.31 15.35 Favored 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 103.606 -2.739 . . . . 0.0 103.606 168.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -68.89 85.0 0.32 Allowed 'General case' 0 N--CA 1.495 1.804 0 CA-C-O 124.185 1.945 . . . . 0.0 113.718 -173.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.7 t -151.66 73.12 1.06 Allowed 'General case' 0 CA--C 1.564 1.497 0 CA-C-N 113.01 -1.904 . . . . 0.0 111.165 -174.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 35.9 t -79.49 113.69 17.83 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 104.482 -2.414 . . . . 0.0 104.482 171.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -100.1 112.8 25.11 Favored 'General case' 0 CA--C 1.567 1.626 0 CA-C-O 123.179 1.466 . . . . 0.0 114.656 -170.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -82.46 144.66 30.3 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 126.118 1.767 . . . . 0.0 110.9 176.023 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -82.9 75.55 9.79 Favored 'General case' 0 CA--C 1.58 2.118 0 O-C-N 120.452 -1.405 . . . . 0.0 108.186 171.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.406 11.8 t 55.04 -106.63 0.34 Allowed 'General case' 0 N--CA 1.5 2.034 0 C-N-CA 126.275 1.83 . . . . 0.0 113.207 -173.293 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -103.22 -18.11 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.291 0 CA-C-N 120.68 1.582 . . . . 0.0 114.042 174.256 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.1 tp -72.74 121.74 20.35 Favored 'General case' 0 CA--C 1.569 1.707 0 CA-C-N 121.24 1.836 . . . . 0.0 108.838 173.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 82.1 p -83.86 100.49 11.01 Favored 'General case' 0 CA--C 1.568 1.654 0 N-CA-C 118.823 2.897 . . . . 0.0 118.823 -171.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 38.9 tp -149.23 87.29 1.52 Allowed 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 102.63 -3.1 . . . . 0.0 102.63 171.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 m -100.3 122.16 42.64 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 -171.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -133.49 137.27 45.57 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 124.679 1.192 . . . . 0.0 109.163 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 63.4 m -66.04 142.65 57.74 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 119.501 -1.999 . . . . 0.0 113.28 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -137.69 -172.95 3.36 Favored 'General case' 0 CA--C 1.569 1.691 0 CA-C-N 113.433 -1.712 . . . . 0.0 112.754 -174.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 37.8 tp -90.9 150.8 21.37 Favored 'General case' 0 CA--C 1.573 1.836 0 CA-C-O 122.264 1.031 . . . . 0.0 112.457 176.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -70.38 155.31 40.86 Favored 'General case' 0 CA--C 1.574 1.866 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 173.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.46 150.63 36.67 Favored 'General case' 0 CA--C 1.571 1.762 0 CA-C-O 124.561 2.124 . . . . 0.0 114.043 -174.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -124.61 168.17 13.5 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.186 -1.824 . . . . 0.0 110.857 -175.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -54.41 133.98 45.61 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.907 -1.121 . . . . 0.0 112.616 -176.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.391 8.8 p30 67.77 17.41 9.77 Favored 'General case' 0 CA--C 1.585 2.326 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -171.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.1 t -118.14 153.3 34.03 Favored 'General case' 0 CA--C 1.567 1.607 0 O-C-N 120.78 -1.2 . . . . 0.0 110.253 173.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -60.01 122.67 14.9 Favored 'General case' 0 CA--C 1.572 1.802 0 N-CA-C 117.448 2.388 . . . . 0.0 117.448 -174.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.2 t -142.81 132.52 23.93 Favored 'General case' 0 CA--C 1.56 1.352 0 CA-C-N 113.816 -1.538 . . . . 0.0 110.848 173.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 27.9 t -139.69 158.74 43.6 Favored 'General case' 0 CA--C 1.568 1.666 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 172.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -119.13 126.36 51.42 Favored 'General case' 0 CA--C 1.571 1.751 0 CA-C-O 124.599 2.142 . . . . 0.0 112.169 -173.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 19.8 p90 -146.47 -142.16 0.12 Allowed 'General case' 0 CA--C 1.579 2.095 0 CA-C-N 111.942 -2.39 . . . . 0.0 108.324 -172.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.0 m -63.95 111.33 2.45 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 119.537 -1.977 . . . . 0.0 109.336 171.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.458 2.3 mt -112.1 42.16 1.82 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 117.83 2.53 . . . . 0.0 117.83 -178.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . 0.362 0.5 OUTLIER -153.7 29.87 0.47 Allowed 'General case' 0 CA--C 1.583 2.246 0 CA-C-N 113.353 -1.749 . . . . 0.0 112.141 166.541 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -123.18 -131.86 3.88 Favored Glycine 0 CA--C 1.548 2.155 0 N-CA-C 108.722 -1.751 . . . . 0.0 108.722 172.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 14.2 t -101.84 144.09 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.503 0 O-C-N 121.169 -1.195 . . . . 0.0 108.795 170.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 15.3 m-30 -114.21 136.9 52.44 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 -169.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.36 -48.6 55.59 Favored 'General case' 0 CA--C 1.578 2.048 0 O-C-N 120.886 -1.134 . . . . 0.0 112.723 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.12 113.6 10.14 Favored 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 102.155 -3.276 . . . . 0.0 102.155 172.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 60.8 m -54.4 148.55 23.74 Favored Pre-proline 0 CA--C 1.587 2.387 0 N-CA-C 115.008 1.485 . . . . 0.0 115.008 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -64.74 169.06 12.12 Favored 'Trans proline' 0 CA--C 1.568 2.206 0 C-N-CA 122.384 2.056 . . . . 0.0 116.602 -173.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 83.8 m -67.72 154.03 42.41 Favored 'General case' 0 CA--C 1.572 1.824 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 -178.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.86 173.99 2.07 Favored 'General case' 0 CA--C 1.579 2.081 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -62.65 108.1 1.09 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.551 -1.343 . . . . 0.0 112.363 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 112.1 -22.51 18.21 Favored Glycine 0 N--CA 1.497 2.743 0 N-CA-C 117.749 1.859 . . . . 0.0 117.749 -173.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.9 mp -98.9 152.21 20.01 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-N 119.064 1.432 . . . . 0.0 112.531 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.3 159.49 15.21 Favored 'General case' 0 CA--C 1.564 1.487 0 CA-C-O 122.508 1.147 . . . . 0.0 112.556 177.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 4.9 t -89.44 96.54 10.75 Favored 'General case' 0 CA--C 1.573 1.845 0 N-CA-C 105.95 -1.87 . . . . 0.0 105.95 172.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -96.7 123.05 40.27 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.69 -1.256 . . . . 0.0 114.374 -171.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 79.42 61.27 2.35 Favored Glycine 0 N--CA 1.495 2.608 0 N-CA-C 115.382 0.913 . . . . 0.0 115.382 -176.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -83.03 83.4 7.85 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.865 0.84 . . . . 0.0 112.707 -167.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -95.53 12.44 29.51 Favored 'General case' 0 CA--C 1.575 1.906 0 N-CA-C 117.059 2.244 . . . . 0.0 117.059 -174.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 88.7 p -76.32 83.69 3.09 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-N 121.412 1.915 . . . . 0.0 111.659 -176.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.4 mt -78.24 74.76 4.78 Favored 'General case' 0 CA--C 1.566 1.596 0 CA-C-O 123.478 1.609 . . . . 0.0 114.134 -173.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 12.9 p -58.95 -36.74 63.32 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 174.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -121.26 53.76 0.69 Allowed Glycine 0 N--CA 1.493 2.444 0 N-CA-C 115.553 0.981 . . . . 0.0 115.553 174.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.1 t -155.37 -59.92 0.11 Allowed 'General case' 0 N--CA 1.498 1.956 0 CA-C-N 118.619 1.21 . . . . 0.0 113.684 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.295 0.2 OUTLIER -136.07 -78.99 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.492 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 5.9 p -140.35 142.98 35.52 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 123.394 1.568 . . . . 0.0 112.659 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -65.92 -20.7 66.3 Favored 'General case' 0 CA--C 1.579 2.095 0 N-CA-C 115.653 1.723 . . . . 0.0 115.653 172.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 80.7 p -96.1 69.86 2.78 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-O 125.313 2.482 . . . . 0.0 113.213 -173.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 26.3 m120 -151.96 100.7 2.67 Favored 'General case' 0 CA--C 1.56 1.359 0 CA-C-N 110.65 -2.977 . . . . 0.0 103.381 -178.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.7 m-30 -118.67 154.27 32.99 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.209 -1.557 . . . . 0.0 115.187 -172.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -94.25 -162.75 35.54 Favored Glycine 0 N--CA 1.488 2.15 0 CA-C-N 115.083 -0.962 . . . . 0.0 113.752 173.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.1 mm -135.53 142.74 38.65 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.009 0 O-C-N 121.761 -0.846 . . . . 0.0 110.537 -176.319 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 19.3 m -70.79 130.31 41.36 Favored 'General case' 0 CA--C 1.569 1.709 0 O-C-N 120.169 -1.582 . . . . 0.0 113.375 173.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -143.33 155.07 44.35 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 123.228 1.49 . . . . 0.0 112.439 175.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -97.95 73.99 2.29 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 122.794 1.283 . . . . 0.0 111.617 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.7 p -78.86 -54.08 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.7 -74.09 1.59 Allowed Glycine 0 N--CA 1.491 2.337 0 O-C-N 121.256 -0.902 . . . . 0.0 114.963 -176.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 47.6 tpt85 -90.24 85.48 6.25 Favored 'General case' 0 CA--C 1.57 1.713 0 CA-C-O 122.251 1.024 . . . . 0.0 110.984 175.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.7 t . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 124.026 1.869 . . . . 0.0 113.489 -178.266 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.257 79.8 t . . . . . 0 CA--C 1.58 2.12 0 CA-C-O 116.077 -1.916 . . . . 0.0 108.793 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -74.12 169.82 21.56 Favored 'Trans proline' 0 CA--C 1.572 2.393 0 CA-C-N 125.388 2.96 . . . . 0.0 114.9 174.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -108.72 83.93 2.3 Favored Pre-proline 0 CA--C 1.583 2.239 0 CA-C-O 117.638 -1.172 . . . . 0.0 111.547 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -85.7 79.95 2.01 Favored 'Trans proline' 0 CA--C 1.573 2.441 0 C-N-CA 122.678 2.252 . . . . 0.0 115.574 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -99.58 49.01 0.94 Allowed 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 177.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.38 -6.49 61.87 Favored Glycine 0 N--CA 1.501 3.026 0 N-CA-C 121.604 3.402 . . . . 0.0 121.604 -177.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 9.2 tp -68.3 -28.03 39.13 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.213 0 N-CA-C 115.598 1.703 . . . . 0.0 115.598 167.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 41.4 mm -102.34 -59.84 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 CA-C-N 119.47 1.032 . . . . 0.0 110.53 176.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.6 pt -98.45 139.92 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 CA-C-O 122.89 1.329 . . . . 0.0 112.159 -174.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -148.21 98.13 2.87 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 -173.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.4 tp -150.23 115.33 5.38 Favored 'General case' 0 CA--C 1.577 1.998 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 173.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -75.55 162.31 28.4 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 115.845 1.795 . . . . 0.0 115.845 -172.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.91 140.86 56.38 Favored 'General case' 0 CA--C 1.574 1.869 0 CA-C-O 122.481 1.134 . . . . 0.0 113.809 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.91 2.35 61.12 Favored Glycine 0 N--CA 1.496 2.659 0 N-CA-C 117.856 1.902 . . . . 0.0 117.856 -174.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -112.42 133.04 54.72 Favored 'General case' 0 CA--C 1.566 1.565 0 CA-C-N 118.935 1.367 . . . . 0.0 110.082 -175.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.9 tt -68.33 119.86 13.52 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.424 -0.797 . . . . 0.0 111.834 -176.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 24.7 p -128.07 158.42 38.01 Favored 'General case' 0 CA--C 1.558 1.268 0 CA-C-O 122.35 1.072 . . . . 0.0 112.798 -175.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.8 mt -92.98 -73.67 0.55 Allowed 'General case' 0 CA--C 1.568 1.664 0 O-C-N 120.835 -1.166 . . . . 0.0 108.61 173.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -91.94 150.75 20.85 Favored 'General case' 0 CA--C 1.569 1.674 0 N-CA-C 115.822 1.786 . . . . 0.0 115.822 178.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.1 m -68.56 -16.51 63.89 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 124.93 1.292 . . . . 0.0 114.162 170.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . 0.325 . . -75.03 28.64 0.09 Allowed 'General case' 0 CA--C 1.594 2.645 0 C-N-CA 126.608 1.963 . . . . 0.0 114.036 171.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -138.52 -39.52 0.52 Allowed 'General case' 0 CA--C 1.583 2.217 0 C-N-CA 127.731 2.413 . . . . 0.0 113.126 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.9 m -65.18 -171.67 0.08 Allowed 'General case' 0 CA--C 1.587 2.388 0 CA-C-N 121.817 2.099 . . . . 0.0 115.201 -177.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -70.12 -57.63 4.73 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 119.101 -2.249 . . . . 0.0 115.225 -175.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 36.3 m -82.37 -78.87 0.19 Allowed 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 173.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -174.49 68.95 0.03 OUTLIER 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 173.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.3 t -151.87 94.24 1.95 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 118.885 -2.385 . . . . 0.0 116.553 -174.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 26.3 t -95.63 112.61 24.29 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 101.283 -3.599 . . . . 0.0 101.283 168.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -91.7 124.06 35.56 Favored 'General case' 0 CA--C 1.562 1.421 0 CA-C-O 122.548 1.166 . . . . 0.0 113.786 -171.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -79.27 131.96 36.32 Favored 'General case' 0 CA--C 1.56 1.361 0 C-N-CA 125.098 1.359 . . . . 0.0 112.031 -174.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.83 31.29 0.09 Allowed 'General case' 0 CA--C 1.585 2.293 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.253 24.9 p 70.31 100.69 0.06 Allowed 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 126.47 1.908 . . . . 0.0 112.096 179.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.29 3.7 mp 72.83 -63.66 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 C-N-CA 125.477 1.511 . . . . 0.0 111.614 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.7 tp -68.26 128.89 38.21 Favored 'General case' 0 CA--C 1.571 1.755 0 CA-C-N 120.624 1.556 . . . . 0.0 110.776 174.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.9 p -86.65 31.5 0.68 Allowed 'General case' 0 CA--C 1.571 1.782 0 N-CA-C 118.954 2.946 . . . . 0.0 118.954 -173.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 31.3 tp -82.42 93.61 7.25 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 172.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.1 m -97.35 148.93 22.66 Favored 'General case' 0 CA--C 1.566 1.56 0 CA-C-O 123.325 1.536 . . . . 0.0 114.022 -170.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 57.2 ttm-85 -141.2 137.2 32.47 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.197 -0.939 . . . . 0.0 109.676 -176.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 58.7 m -61.07 140.09 57.94 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 119.632 -1.917 . . . . 0.0 111.896 175.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.69 178.12 7.46 Favored 'General case' 0 CA--C 1.565 1.548 0 N-CA-C 116.492 2.034 . . . . 0.0 116.492 -172.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.8 tp -86.77 149.6 24.75 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-O 122.26 1.029 . . . . 0.0 112.248 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -67.12 141.1 57.54 Favored 'General case' 0 CA--C 1.572 1.793 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 174.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.73 162.12 28.48 Favored 'General case' 0 CA--C 1.571 1.774 0 CA-C-O 124.181 1.943 . . . . 0.0 115.173 -176.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -111.09 -178.81 3.56 Favored 'General case' 0 CA--C 1.567 1.61 0 CA-C-N 113.397 -1.729 . . . . 0.0 113.082 -173.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -60.0 135.34 57.68 Favored 'General case' 0 CA--C 1.568 1.648 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -176.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 66.72 38.14 4.0 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 124.902 1.281 . . . . 0.0 113.307 -173.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 10.9 t -128.19 140.36 51.95 Favored 'General case' 0 CA--C 1.561 1.391 0 O-C-N 121.011 -1.055 . . . . 0.0 111.991 178.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -73.06 97.05 2.27 Favored 'General case' 0 CA--C 1.572 1.793 0 C-N-CA 124.13 0.972 . . . . 0.0 112.226 178.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.16 136.48 36.57 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-O 122.117 0.961 . . . . 0.0 112.057 177.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 91.8 p -88.06 116.12 26.02 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 105.226 -2.139 . . . . 0.0 105.226 171.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -80.02 -117.9 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.964 0 CA-C-O 116.219 -1.848 . . . . 0.0 114.583 -172.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -130.42 154.0 48.18 Favored 'General case' 0 CA--C 1.567 1.6 1 N-CA-C 123.486 4.625 . . . . 0.0 123.486 -170.165 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.434 24.0 p 43.29 122.15 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.258 0 CA-C-N 108.4 -4.0 . . . . 0.0 116.378 -172.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.418 0.0 OUTLIER -145.54 -71.55 0.26 Allowed 'General case' 0 CA--C 1.576 1.946 1 CA-C-N 107.695 -4.32 . . . . 0.0 102.142 -173.309 . . . . . . . . 4 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -158.99 -30.77 0.07 Allowed 'General case' 0 CA--C 1.591 2.55 0 C-N-CA 127.694 2.398 . . . . 0.0 110.474 171.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 122.93 43.82 0.35 Allowed Glycine 0 CA--C 1.556 2.605 0 N-CA-C 117.436 1.735 . . . . 0.0 117.436 -172.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 11.3 t -138.84 132.68 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.422 0 CA-C-N 122.958 3.379 . . . . 0.0 106.428 145.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -117.84 132.11 56.48 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.744 -172.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -61.97 -42.62 99.33 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 120.038 -1.663 . . . . 0.0 115.402 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -142.76 119.27 11.0 Favored 'General case' 0 CA--C 1.562 1.408 0 N-CA-C 105.277 -2.12 . . . . 0.0 105.277 174.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 84.2 m -44.17 148.95 0.75 Allowed Pre-proline 0 CA--C 1.593 2.607 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 -176.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -70.05 42.23 0.36 Allowed 'Trans proline' 0 CA--C 1.574 2.519 1 N-CA-C 122.521 4.008 . . . . 0.0 122.521 -171.256 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 67.6 m 58.98 154.13 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 117.516 2.413 . . . . 0.0 117.516 175.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -62.27 151.83 35.31 Favored 'General case' 0 CA--C 1.573 1.837 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -179.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -68.98 104.08 2.0 Favored 'General case' 0 CA--C 1.573 1.84 0 CA-C-O 122.38 1.086 . . . . 0.0 112.324 -174.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 136.44 -29.49 2.79 Favored Glycine 0 N--CA 1.497 2.742 0 N-CA-C 116.108 1.203 . . . . 0.0 116.108 -173.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.5 mp -96.88 144.6 26.67 Favored 'General case' 0 CA--C 1.566 1.567 0 C-N-CA 124.372 1.069 . . . . 0.0 111.538 177.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -99.43 135.77 40.36 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 122.012 0.911 . . . . 0.0 111.567 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 30.3 t -94.99 113.89 25.64 Favored 'General case' 0 CA--C 1.568 1.641 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.669 175.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -92.94 81.16 4.6 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.122 -1.611 . . . . 0.0 113.319 -174.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -34.95 85.11 0.01 OUTLIER Glycine 0 N--CA 1.503 3.15 0 N-CA-C 121.829 3.492 . . . . 0.0 121.829 -177.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -83.36 68.43 9.69 Favored 'General case' 0 CA--C 1.577 2.003 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 -169.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 66.8 mttm 66.69 -56.98 0.4 Allowed 'General case' 0 N--CA 1.509 2.489 0 N-CA-C 118.211 2.671 . . . . 0.0 118.211 174.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . 0.289 66.1 m 74.44 -40.48 0.45 Allowed 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -178.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -17.77 62.07 Favored 'General case' 0 CA--C 1.58 2.113 0 N-CA-C 116.222 1.934 . . . . 0.0 116.222 173.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.8 p -82.46 74.12 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.578 2.027 0 CA-C-O 123.682 1.705 . . . . 0.0 112.474 178.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -154.5 85.19 0.14 Allowed Glycine 0 N--CA 1.487 2.034 0 CA-C-N 115.091 -0.959 . . . . 0.0 112.421 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 30.0 t -77.03 42.05 0.31 Allowed 'General case' 0 CA--C 1.583 2.226 0 N-CA-C 117.604 2.446 . . . . 0.0 117.604 -175.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 17.9 tt -160.02 -74.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 174.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 3.3 p -125.44 139.76 53.36 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 122.898 1.333 . . . . 0.0 109.94 173.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -82.24 53.23 2.2 Favored 'General case' 0 CA--C 1.574 1.899 0 N-CA-C 115.521 1.674 . . . . 0.0 115.521 -177.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 40.3 p -103.45 71.35 1.09 Allowed 'General case' 0 N--CA 1.502 2.133 0 CA-C-O 124.966 2.317 . . . . 0.0 109.667 174.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -135.11 95.58 3.33 Favored 'General case' 0 CA--C 1.564 1.498 0 CA-C-N 111.521 -2.581 . . . . 0.0 108.057 -174.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -131.51 -178.34 4.81 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 120.651 -1.281 . . . . 0.0 112.49 -174.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -73.6 135.61 20.9 Favored Glycine 0 N--CA 1.487 2.048 0 N-CA-C 116.645 1.418 . . . . 0.0 116.645 -179.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.6 mm -89.76 134.15 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 CA-C-O 122.743 1.259 . . . . 0.0 109.047 -174.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 69.6 m -80.81 122.42 27.16 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -132.79 153.02 51.65 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 122.733 1.254 . . . . 0.0 110.701 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -93.61 127.14 39.14 Favored 'General case' 0 CA--C 1.56 1.36 0 CA-C-O 122.834 1.302 . . . . 0.0 110.617 -174.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.4 p -141.39 -50.03 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-N 114.124 -1.398 . . . . 0.0 113.422 -173.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 70.49 71.97 0.95 Allowed Glycine 0 N--CA 1.494 2.518 0 N-CA-C 116.397 1.319 . . . . 0.0 116.397 176.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 86.7 mtm180 71.95 -65.79 0.33 Allowed 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 124.499 1.12 . . . . 0.0 112.539 -173.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.1 m . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 125.13 2.395 . . . . 0.0 108.138 174.599 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 41.9 t . . . . . 0 CA--C 1.579 2.059 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -60.19 99.08 0.13 Allowed 'Trans proline' 0 CA--C 1.57 2.287 0 C-N-CA 123.038 2.492 . . . . 0.0 116.959 -178.933 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -112.24 96.13 33.73 Favored Pre-proline 0 CA--C 1.576 1.957 0 CA-C-O 118.162 -0.923 . . . . 0.0 109.92 -179.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -80.88 71.84 6.84 Favored 'Trans proline' 0 CA--C 1.57 2.29 0 C-N-CA 122.419 2.079 . . . . 0.0 114.935 -178.855 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 76.3 mtp180 -80.48 -59.27 2.76 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -176.885 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -125.11 62.2 0.59 Allowed Glycine 0 N--CA 1.495 2.623 0 O-C-N 121.428 -0.795 . . . . 0.0 115.038 174.686 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 28.8 mt -121.04 -55.17 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 C-N-CA 123.484 0.714 . . . . 0.0 110.305 -177.483 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.4 mp 61.65 66.87 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 C-N-CA 125.083 1.353 . . . . 0.0 112.706 176.412 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 36.8 pt -134.42 171.3 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 120.995 -1.066 . . . . 0.0 111.999 -178.816 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.253 69.3 m-80 97.6 89.16 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 127.339 2.255 . . . . 0.0 111.308 -179.682 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -141.75 164.3 30.56 Favored 'General case' 0 CA--C 1.577 2.011 0 CA-C-O 122.519 1.152 . . . . 0.0 111.491 173.746 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -80.14 167.34 20.48 Favored 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 116.291 1.96 . . . . 0.0 116.291 -173.231 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -72.03 138.91 48.25 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.433 0.693 . . . . 0.0 110.418 175.005 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 92.83 5.84 64.14 Favored Glycine 0 CA--C 1.558 2.766 0 N-CA-C 116.23 1.252 . . . . 0.0 116.23 -172.149 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -109.09 144.38 37.2 Favored 'General case' 0 CA--C 1.567 1.611 0 CA-C-N 119.002 1.401 . . . . 0.0 109.925 174.475 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 tt -67.4 115.45 7.06 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -174.744 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.5 p -110.91 152.82 26.3 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 124.359 1.063 . . . . 0.0 113.264 179.411 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.3 mt -84.54 -78.69 0.24 Allowed 'General case' 0 CA--C 1.568 1.657 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 174.127 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -96.09 177.85 5.6 Favored 'General case' 0 CA--C 1.578 2.052 0 O-C-N 121.202 -0.936 . . . . 0.0 113.191 172.795 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.1 m -77.37 -19.37 56.32 Favored 'General case' 0 N--CA 1.504 2.25 0 N-CA-C 116.48 2.03 . . . . 0.0 116.48 174.894 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.32 17.71 0.47 Allowed 'General case' 0 CA--C 1.581 2.164 0 N-CA-C 116.655 2.095 . . . . 0.0 116.655 173.939 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -96.9 -48.87 5.26 Favored 'General case' 0 CA--C 1.57 1.723 0 C-N-CA 125.127 1.371 . . . . 0.0 114.1 -177.194 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 87.9 m -81.19 170.63 15.89 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 115.965 1.839 . . . . 0.0 115.965 -177.4 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -63.06 -55.83 22.15 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 123.561 0.745 . . . . 0.0 109.283 171.531 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.4 t -82.56 100.4 10.1 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 104.166 -2.531 . . . . 0.0 104.166 169.077 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -72.67 71.86 1.01 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 125.081 2.372 . . . . 0.0 114.39 -173.642 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 t -148.02 86.19 1.56 Allowed 'General case' 0 CA--C 1.559 1.316 0 CA-C-N 112.373 -2.194 . . . . 0.0 109.513 -173.531 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.7 t -80.66 119.5 23.37 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 120.586 -1.321 . . . . 0.0 107.908 173.857 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.9 tp60 -101.42 117.51 35.08 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.542 1.137 . . . . 0.0 113.22 -172.96 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 8.4 m170 -60.73 159.59 10.69 Favored 'General case' 0 CA--C 1.567 1.603 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 177.162 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -89.91 60.37 4.92 Favored 'General case' 0 CA--C 1.578 2.04 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 171.126 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.7 m 80.96 -75.3 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.191 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 -169.06 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.0 mt -138.2 -115.25 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.584 2.253 0 N-CA-C 103.502 -2.777 . . . . 0.0 103.502 172.535 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.251 3.8 mm? 41.59 -107.89 0.09 Allowed 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 127.123 2.169 . . . . 0.0 114.806 174.56 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 89.8 p -152.1 -111.3 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.315 0 CA-C-O 116.133 -1.889 . . . . 0.0 109.709 173.27 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.0 tp 23.24 60.97 0.04 OUTLIER 'General case' 0 N--CA 1.514 2.761 0 CA-C-N 121.362 1.892 . . . . 0.0 115.683 -174.35 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 45.2 m -99.17 119.15 37.39 Favored 'General case' 0 CA--C 1.554 1.098 0 CA-C-N 114.257 -1.338 . . . . 0.0 112.298 -170.664 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -99.11 165.65 11.62 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.961 -0.462 . . . . 0.0 110.469 175.083 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 45.9 m -80.59 152.16 28.71 Favored 'General case' 0 CA--C 1.563 1.475 0 O-C-N 119.064 -2.272 . . . . 0.0 112.12 173.447 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.66 -178.76 5.67 Favored 'General case' 0 CA--C 1.569 1.675 0 CA-C-N 113.282 -1.781 . . . . 0.0 112.689 -173.915 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -88.42 137.32 32.43 Favored 'General case' 0 CA--C 1.568 1.642 0 O-C-N 121.01 -1.056 . . . . 0.0 112.571 179.629 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.97 155.42 30.8 Favored 'General case' 0 CA--C 1.576 1.979 0 CA-C-O 121.868 0.842 . . . . 0.0 110.709 172.422 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.53 156.43 27.77 Favored 'General case' 0 CA--C 1.568 1.642 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 -173.634 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 22.7 mtm180 -129.29 172.93 10.99 Favored 'General case' 0 CA--C 1.563 1.47 0 CA-C-N 112.806 -1.997 . . . . 0.0 109.761 177.558 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -48.77 130.45 17.73 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 115.62 1.711 . . . . 0.0 115.62 -173.891 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.8 m120 77.19 10.24 2.52 Favored 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 -174.182 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 30.7 t -109.26 148.75 30.48 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 120.532 1.514 . . . . 0.0 112.268 175.277 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -79.76 112.56 17.16 Favored 'General case' 0 CA--C 1.57 1.744 0 CA-C-O 123.839 1.781 . . . . 0.0 112.747 -178.346 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.97 177.4 5.44 Favored 'General case' 0 CA--C 1.571 1.772 0 CA-C-N 112.304 -2.225 . . . . 0.0 111.048 173.639 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.432 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 58.3 m -79.65 -113.03 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 104.872 -2.27 . . . . 0.0 104.872 170.017 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -160.17 -80.53 0.05 OUTLIER 'General case' 0 CA--C 1.564 1.486 0 CA-C-N 122.862 2.573 . . . . 0.0 110.788 172.272 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -77.63 -46.34 22.36 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 174.743 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.9 p 60.74 153.62 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 124.954 2.312 . . . . 0.0 116.447 -176.858 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -97.59 179.45 4.84 Favored 'General case' 0 CA--C 1.583 2.234 0 CA-C-N 112.71 -2.041 . . . . 0.0 108.685 171.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -84.76 12.84 6.54 Favored 'General case' 0 N--CA 1.514 2.743 0 O-C-N 118.422 -2.674 . . . . 0.0 114.036 174.009 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -113.41 -152.42 11.0 Favored Glycine 0 N--CA 1.476 1.357 0 O-C-N 120.99 -1.069 . . . . 0.0 114.226 -173.831 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.5 t -78.49 142.08 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 CA-C-O 122.912 1.339 . . . . 0.0 111.314 -167.442 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -119.51 153.61 35.09 Favored 'General case' 0 CA--C 1.561 1.393 0 N-CA-C 116.468 2.025 . . . . 0.0 116.468 -171.329 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -83.03 -56.08 4.0 Favored 'General case' 0 CA--C 1.577 2.016 0 CA-C-N 113.253 -1.794 . . . . 0.0 110.077 172.964 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -133.16 108.01 8.54 Favored 'General case' 0 CA--C 1.564 1.505 0 N-CA-C 104.606 -2.368 . . . . 0.0 104.606 173.448 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.6 m -52.11 153.06 5.08 Favored Pre-proline 0 CA--C 1.584 2.259 0 N-CA-C 118.433 2.753 . . . . 0.0 118.433 -175.333 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -70.31 172.29 13.45 Favored 'Trans proline' 0 CA--C 1.568 2.204 0 C-N-CA 122.687 2.258 . . . . 0.0 115.574 -177.904 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 60.4 m -70.77 156.39 39.58 Favored 'General case' 0 CA--C 1.571 1.754 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 177.312 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.53 168.55 3.56 Favored 'General case' 0 CA--C 1.58 2.099 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 174.793 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 91.5 mtt180 -63.03 112.16 2.48 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.227 -1.546 . . . . 0.0 113.492 -175.52 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 114.42 -22.83 13.0 Favored Glycine 0 N--CA 1.495 2.622 0 N-CA-C 118.926 2.33 . . . . 0.0 118.926 -173.984 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.7 mp -99.43 143.76 29.31 Favored 'General case' 0 CA--C 1.572 1.792 0 CA-C-N 119.462 1.631 . . . . 0.0 112.877 -176.02 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -102.23 155.44 18.22 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 124.116 0.967 . . . . 0.0 113.413 -177.308 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.432 ' SG ' ' O ' ' A' ' 50' ' ' SER . 1.9 t -94.67 83.71 4.12 Favored 'General case' 0 CA--C 1.579 2.079 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 179.684 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -131.2 121.59 25.1 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.476 -1.39 . . . . 0.0 112.034 -176.703 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 157.02 -68.18 0.29 Allowed Glycine 0 N--CA 1.496 2.661 0 O-C-N 120.528 -1.357 . . . . 0.0 114.258 175.52 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -80.91 169.06 18.02 Favored 'General case' 0 CA--C 1.577 1.99 0 CA-C-O 121.858 0.837 . . . . 0.0 111.525 166.937 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.47 106.17 1.3 Allowed 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 106.382 -1.71 . . . . 0.0 106.382 -179.583 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.3 m -93.83 83.48 4.4 Favored 'General case' 0 CA--C 1.56 1.333 0 CA-C-O 122.446 1.117 . . . . 0.0 113.679 -173.541 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.9 mp -87.22 61.96 7.0 Favored 'General case' 0 CA--C 1.58 2.115 0 CA-C-O 122.041 0.924 . . . . 0.0 111.607 175.747 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 55.5 t -136.53 93.66 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 -176.264 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.96 66.24 3.62 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 115.998 1.159 . . . . 0.0 115.998 175.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 36.0 t -128.3 -123.93 0.23 Allowed 'General case' 0 CA--C 1.574 1.88 0 C-N-CA 123.736 0.814 . . . . 0.0 110.333 179.449 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.4 pt -87.68 -64.8 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.143 0 O-C-N 120.3 -1.5 . . . . 0.0 112.26 179.568 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 29.8 p -114.12 -178.66 3.43 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 119.655 1.116 . . . . 0.0 110.665 174.461 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 37.6 t30 64.64 67.53 0.55 Allowed 'General case' 0 N--CA 1.503 2.213 0 O-C-N 120.857 -1.152 . . . . 0.0 107.999 -172.737 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 36.4 p -98.64 -57.37 2.2 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 -169.925 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -157.63 81.88 0.89 Allowed 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 175.726 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.9 m-30 -112.53 161.33 16.88 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 -173.792 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -160.55 167.31 35.69 Favored Glycine 0 CA--C 1.556 2.61 0 C-N-CA 124.895 1.236 . . . . 0.0 112.866 -179.573 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.5 mm -98.35 134.14 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.519 0 O-C-N 119.582 -2.128 . . . . 0.0 110.436 -179.388 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 94.9 m -63.21 123.83 19.64 Favored 'General case' 0 CA--C 1.572 1.792 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 174.662 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 79.0 m-70 -144.33 155.48 43.83 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-O 122.553 1.168 . . . . 0.0 111.613 175.57 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 40.0 t-20 -96.71 122.92 40.18 Favored 'General case' 0 CA--C 1.566 1.594 0 O-C-N 120.892 -1.13 . . . . 0.0 110.354 179.433 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.5 t -134.74 86.45 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 -174.964 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 84.15 -61.17 4.76 Favored Glycine 0 N--CA 1.496 2.662 0 N-CA-C 117.272 1.669 . . . . 0.0 117.272 -178.653 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? 72.98 92.68 0.08 Allowed 'General case' 0 N--CA 1.497 1.894 0 C-N-CA 125.332 1.453 . . . . 0.0 112.413 179.08 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 83.2 p . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 124.265 1.983 . . . . 0.0 112.873 177.55 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 23.3 m . . . . . 0 CA--C 1.579 2.085 0 CA-C-O 118.967 -0.539 . . . . 0.0 112.15 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -64.9 -28.22 58.59 Favored 'Trans proline' 0 CA--C 1.573 2.449 0 N-CA-C 117.547 2.095 . . . . 0.0 117.547 175.837 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -110.79 82.6 3.07 Favored Pre-proline 0 CA--C 1.581 2.145 0 C-N-CA 124.272 1.029 . . . . 0.0 110.624 174.643 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.85 92.43 1.04 Allowed 'Trans proline' 0 CA--C 1.569 2.239 0 C-N-CA 122.644 2.229 . . . . 0.0 114.341 -177.491 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.5 56.7 3.7 Favored 'General case' 0 CA--C 1.577 2.018 0 N-CA-C 114.776 1.398 . . . . 0.0 114.776 -178.494 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.35 78.77 0.08 OUTLIER Glycine 0 N--CA 1.489 2.196 0 O-C-N 120.901 -1.124 . . . . 0.0 113.737 -178.952 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 11.0 tp -71.48 -31.69 43.74 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.011 0 N-CA-C 117.541 2.422 . . . . 0.0 117.541 -174.041 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.255 41.0 mt 75.87 -49.85 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.658 0 CA-C-N 120.307 1.412 . . . . 0.0 113.542 177.599 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 16.7 pt -96.93 -94.01 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 CA-C-N 120.346 1.43 . . . . 0.0 111.351 -174.191 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.307 0.0 OUTLIER 49.35 75.07 0.16 Allowed 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 116.656 2.095 . . . . 0.0 116.656 -179.993 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 tp -132.34 120.49 22.14 Favored 'General case' 0 CA--C 1.569 1.707 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 -174.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -81.78 173.55 12.18 Favored 'General case' 0 CA--C 1.569 1.693 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 -172.659 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -56.37 137.87 51.94 Favored 'General case' 0 CA--C 1.568 1.652 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 176.787 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.8 -17.49 27.6 Favored Glycine 0 N--CA 1.497 2.734 0 N-CA-C 118.122 2.009 . . . . 0.0 118.122 -177.162 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -100.3 145.56 27.99 Favored 'General case' 0 CA--C 1.564 1.503 0 CA-C-N 118.428 1.114 . . . . 0.0 112.216 -177.251 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 72.6 mt -77.9 137.55 38.42 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 122.08 0.943 . . . . 0.0 113.119 -179.634 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.6 p -138.62 149.65 45.44 Favored 'General case' 0 CA--C 1.562 1.417 0 CA-C-O 122.073 0.939 . . . . 0.0 112.827 -174.567 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 98.7 mt -84.38 -74.04 0.4 Allowed 'General case' 0 CA--C 1.567 1.616 0 O-C-N 121.424 -0.797 . . . . 0.0 109.126 174.434 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.8 p30 -95.06 173.58 7.51 Favored 'General case' 0 CA--C 1.577 1.984 0 CA-C-N 120.111 1.323 . . . . 0.0 113.473 172.846 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.8 m -78.69 -19.27 52.86 Favored 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 116.994 2.22 . . . . 0.0 116.994 174.923 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.72 31.62 0.16 Allowed 'General case' 0 CA--C 1.579 2.083 0 N-CA-C 116.685 2.105 . . . . 0.0 116.685 174.342 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -114.72 -34.77 5.05 Favored 'General case' 0 CA--C 1.576 1.977 0 C-N-CA 126.414 1.886 . . . . 0.0 113.003 174.393 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . 0.273 67.3 m -80.67 -133.82 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.909 0 CA-C-N 120.87 1.668 . . . . 0.0 114.533 -174.983 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.3 -77.43 0.19 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 119.238 -2.164 . . . . 0.0 112.378 -173.777 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 77.4 p -88.33 -63.86 1.23 Allowed 'General case' 0 CA--C 1.568 1.653 0 CA-C-O 122.547 1.165 . . . . 0.0 110.481 173.09 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -169.66 81.78 0.12 Allowed 'General case' 0 CA--C 1.568 1.665 0 N-CA-C 103.991 -2.596 . . . . 0.0 103.991 177.416 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 53.5 t -140.85 62.98 1.47 Allowed 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 118.634 2.827 . . . . 0.0 118.634 -171.71 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 22.7 t -93.39 116.68 29.23 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 170.796 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.31 118.42 36.85 Favored 'General case' 0 CA--C 1.57 1.718 0 CA-C-O 122.663 1.221 . . . . 0.0 113.716 -172.367 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -84.13 125.09 31.83 Favored 'General case' 0 CA--C 1.564 1.491 0 C-N-CA 124.921 1.289 . . . . 0.0 111.184 -178.025 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . 0.3 0.3 OUTLIER -83.41 57.64 4.12 Favored 'General case' 0 CA--C 1.58 2.117 0 O-C-N 120.735 -1.228 . . . . 0.0 114.252 175.191 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.351 18.3 p 90.83 178.77 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.756 0 C-N-CA 127.13 2.172 . . . . 0.0 112.354 -174.897 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 14.8 mm -59.86 -62.45 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 119.616 -1.928 . . . . 0.0 115.282 -172.695 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.5 tp -92.62 79.93 4.82 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-N 120.184 1.356 . . . . 0.0 108.863 174.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.3 p -145.96 172.23 13.67 Favored 'General case' 0 CA--C 1.568 1.67 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 -173.194 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 39.9 tp -88.16 140.08 29.85 Favored 'General case' 0 CA--C 1.574 1.865 0 CA-C-O 121.682 0.753 . . . . 0.0 111.507 174.514 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.5 m -104.61 110.92 23.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.951 -1.093 . . . . 0.0 112.063 -175.024 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.5 ttp180 -121.12 142.02 50.26 Favored 'General case' 0 CA--C 1.567 1.629 0 C-N-CA 124.21 1.004 . . . . 0.0 109.758 178.615 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 55.2 m -69.81 150.78 46.49 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-O 124.776 2.227 . . . . 0.0 114.323 179.03 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -132.39 -178.39 4.9 Favored 'General case' 0 CA--C 1.562 1.442 0 CA-C-N 111.774 -2.466 . . . . 0.0 113.111 -174.18 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.1 mt -84.89 138.19 32.68 Favored 'General case' 0 CA--C 1.567 1.597 0 O-C-N 121.242 -0.911 . . . . 0.0 111.742 177.75 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -68.4 139.64 55.8 Favored 'General case' 0 CA--C 1.576 1.945 0 O-C-N 121.56 -0.712 . . . . 0.0 111.065 173.841 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.39 151.31 39.72 Favored 'General case' 0 CA--C 1.57 1.712 0 N-CA-C 118.122 2.638 . . . . 0.0 118.122 -171.359 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 50.5 mtp180 -104.1 168.95 8.78 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 112.809 -1.996 . . . . 0.0 111.866 -178.903 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -52.77 126.68 20.81 Favored 'General case' 0 CA--C 1.573 1.837 0 N-CA-C 114.222 1.194 . . . . 0.0 114.222 -174.915 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 71.66 32.65 1.95 Allowed 'General case' 0 N--CA 1.503 2.214 0 C-N-CA 125.132 1.373 . . . . 0.0 113.599 -172.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.7 m -130.24 153.49 48.55 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.685 -1.26 . . . . 0.0 111.033 174.83 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -69.98 136.1 50.1 Favored 'General case' 0 CA--C 1.574 1.882 0 CA-C-O 124.002 1.858 . . . . 0.0 114.412 -176.177 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.7 p -138.93 148.25 43.32 Favored 'General case' 0 CA--C 1.566 1.593 0 CA-C-N 112.563 -2.108 . . . . 0.0 111.496 -178.372 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.3 m -78.25 107.76 11.09 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.277 -1.514 . . . . 0.0 108.253 174.299 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.34 -40.14 62.36 Favored 'General case' 0 CA--C 1.57 1.718 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -174.618 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -86.36 145.65 26.8 Favored 'General case' 0 CA--C 1.571 1.781 0 C-N-CA 124.344 1.058 . . . . 0.0 109.202 172.278 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.7 p -123.93 145.7 48.96 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-O 123.796 1.76 . . . . 0.0 109.867 173.406 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.264 0.6 OUTLIER -109.1 -135.25 0.35 Allowed 'General case' 0 CA--C 1.565 1.55 0 CA-C-N 113.404 -1.725 . . . . 0.0 106.668 174.551 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -130.95 71.34 1.47 Allowed 'General case' 0 CA--C 1.569 1.69 0 N-CA-C 104.023 -2.584 . . . . 0.0 104.023 170.178 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 169.74 -159.72 32.52 Favored Glycine 0 N--CA 1.486 1.968 0 N-CA-C 117.125 1.61 . . . . 0.0 117.125 -174.177 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.2 t -79.19 146.92 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.99 0 CA-C-O 122.343 1.068 . . . . 0.0 112.277 -166.801 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -123.87 158.41 31.95 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -173.153 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -86.16 -21.91 27.3 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 174.373 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -146.37 122.8 11.01 Favored 'General case' 0 CA--C 1.564 1.519 0 N-CA-C 105.507 -2.035 . . . . 0.0 105.507 177.826 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 56.9 m -58.91 134.05 87.07 Favored Pre-proline 0 CA--C 1.597 2.775 0 O-C-N 119.888 -1.758 . . . . 0.0 115.27 -179.907 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -66.76 64.77 0.56 Allowed 'Trans proline' 0 CA--C 1.581 2.825 0 N-CA-C 121.307 3.541 . . . . 0.0 121.307 -174.064 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 69.1 m 58.53 164.0 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 175.838 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -79.21 166.27 22.36 Favored 'General case' 0 CA--C 1.576 1.977 0 O-C-N 120.64 -1.287 . . . . 0.0 113.934 174.287 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -63.43 115.29 4.49 Favored 'General case' 0 CA--C 1.573 1.864 0 O-C-N 120.965 -1.085 . . . . 0.0 113.612 -178.05 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 107.31 -17.99 36.46 Favored Glycine 0 N--CA 1.5 2.931 0 N-CA-C 118.311 2.084 . . . . 0.0 118.311 -174.193 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.1 mp -98.04 151.81 19.94 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-N 118.584 1.192 . . . . 0.0 111.638 179.049 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -100.26 149.87 23.14 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.835 -1.166 . . . . 0.0 112.192 175.982 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 11.8 t -92.6 120.03 32.64 Favored 'General case' 0 CA--C 1.567 1.634 0 CA-C-N 115.07 -0.968 . . . . 0.0 108.892 172.924 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -95.0 80.5 3.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.748 -1.22 . . . . 0.0 110.991 -174.031 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -82.86 69.42 3.37 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 118.636 2.214 . . . . 0.0 118.636 -174.211 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -75.92 -44.3 40.93 Favored 'General case' 0 CA--C 1.574 1.9 0 N-CA-C 115.037 1.495 . . . . 0.0 115.037 176.897 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -137.05 111.74 8.75 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 120.04 1.291 . . . . 0.0 109.212 175.861 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.7 t -155.25 -62.23 0.12 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.398 -0.814 . . . . 0.0 111.709 174.715 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 56.19 82.73 0.1 Allowed 'General case' 0 CA--C 1.579 2.082 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 174.184 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . 0.366 2.3 p 57.87 -52.11 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.286 0 N-CA-C 120.266 3.432 . . . . 0.0 120.266 174.582 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.82 29.9 66.7 Favored Glycine 0 N--CA 1.495 2.605 0 N-CA-C 119.523 2.569 . . . . 0.0 119.523 -177.256 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.2 t -69.93 -39.8 75.9 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 116.253 1.945 . . . . 0.0 116.253 -179.883 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 10.4 tp -119.42 68.5 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.212 0 CA-C-O 123.516 1.627 . . . . 0.0 108.095 172.655 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.253 9.7 t 37.09 118.95 0.0 OUTLIER 'General case' 0 CA--C 1.578 2.037 0 N-CA-C 118.408 2.744 . . . . 0.0 118.408 -173.646 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 57.0 t-20 -150.15 89.01 1.55 Allowed 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 103.73 -2.693 . . . . 0.0 103.73 173.838 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 67.1 p -99.17 71.82 1.84 Allowed 'General case' 0 N--CA 1.496 1.862 0 CA-C-O 124.77 2.224 . . . . 0.0 113.93 -172.126 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -144.78 121.26 11.02 Favored 'General case' 0 CA--C 1.563 1.469 0 CA-C-N 110.645 -2.98 . . . . 0.0 104.808 173.664 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -128.08 161.12 29.97 Favored 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 122.426 1.107 . . . . 0.0 112.212 -173.587 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.39 157.57 51.64 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 115.717 1.047 . . . . 0.0 115.717 177.314 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 33.3 mm -104.52 140.41 22.66 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 121.22 -1.165 . . . . 0.0 110.925 -172.224 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 89.6 m -72.22 122.92 21.87 Favored 'General case' 0 CA--C 1.566 1.561 0 O-C-N 120.567 -1.333 . . . . 0.0 113.465 174.637 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -133.55 151.36 51.72 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.825 -1.172 . . . . 0.0 110.393 176.296 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -94.36 127.3 40.16 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 122.517 1.151 . . . . 0.0 111.271 -174.374 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 9.2 p -144.12 -16.97 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 -173.97 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 89.06 -54.4 3.98 Favored Glycine 0 N--CA 1.496 2.668 0 CA-C-N 120.64 1.564 . . . . 0.0 116.606 -178.641 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -70.32 -6.93 38.65 Favored 'General case' 0 CA--C 1.585 2.31 0 N-CA-C 117.477 2.399 . . . . 0.0 117.477 177.537 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 32.9 t . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 123.779 1.752 . . . . 0.0 111.618 175.493 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 40.0 t . . . . . 0 CA--C 1.579 2.064 0 CA-C-O 117.993 -1.003 . . . . 0.0 108.56 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -77.38 82.23 2.44 Favored 'Trans proline' 0 CA--C 1.57 2.308 0 C-N-CA 122.628 2.219 . . . . 0.0 113.97 -179.315 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 82.62 86.55 0.05 OUTLIER Pre-proline 0 CA--C 1.581 2.148 0 C-N-CA 126.776 2.03 . . . . 0.0 109.515 -174.305 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -66.3 -38.46 20.55 Favored 'Trans proline' 0 CA--C 1.565 2.069 0 N-CA-C 118.097 2.307 . . . . 0.0 118.097 -174.793 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 64.3 ttt-85 -85.33 70.02 10.78 Favored 'General case' 0 CA--C 1.577 2.001 0 CA-C-N 120.025 1.284 . . . . 0.0 110.888 174.241 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 25.31 75.11 0.01 OUTLIER Glycine 0 N--CA 1.5 2.902 0 N-CA-C 121.012 3.165 . . . . 0.0 121.012 179.716 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . 0.334 4.5 tp 46.95 28.73 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.593 2.598 0 N-CA-C 118.73 2.863 . . . . 0.0 118.73 -176.548 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.308 3.3 mp 60.13 52.87 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.592 2.575 0 C-N-CA 125.428 1.491 . . . . 0.0 112.398 177.926 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 5.6 pt -127.69 -108.78 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 120.081 -1.637 . . . . 0.0 107.762 176.865 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 57.54 68.84 0.8 Allowed 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 117.495 2.406 . . . . 0.0 117.495 172.88 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . 0.25 28.3 tp -110.13 133.78 52.87 Favored 'General case' 0 CA--C 1.581 2.136 0 O-C-N 120.665 -1.272 . . . . 0.0 109.392 174.42 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -77.18 160.5 28.91 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 119.509 -1.995 . . . . 0.0 115.369 -173.934 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.38 128.25 34.98 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 122.215 1.007 . . . . 0.0 109.855 173.409 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 96.89 24.37 13.32 Favored Glycine 0 CA--C 1.557 2.663 0 N-CA-C 116.423 1.329 . . . . 0.0 116.423 -172.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -129.27 139.25 51.87 Favored 'General case' 0 CA--C 1.567 1.63 0 CA-C-N 118.533 1.167 . . . . 0.0 109.427 177.638 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.8 mp -65.7 128.74 37.18 Favored 'General case' 0 CA--C 1.574 1.891 0 O-C-N 120.919 -1.113 . . . . 0.0 112.746 -178.063 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.0 p -129.16 154.09 47.08 Favored 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 -174.313 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.4 mt -85.46 -76.82 0.31 Allowed 'General case' 0 CA--C 1.568 1.64 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 173.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.8 p30 -97.35 172.92 7.47 Favored 'General case' 0 CA--C 1.577 2.002 0 CA-C-N 120.003 1.274 . . . . 0.0 113.747 172.915 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.6 m -77.75 -20.63 53.1 Favored 'General case' 0 N--CA 1.505 2.28 0 N-CA-C 116.956 2.206 . . . . 0.0 116.956 175.001 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.58 10.74 1.56 Allowed 'General case' 0 CA--C 1.575 1.928 0 N-CA-C 117.292 2.33 . . . . 0.0 117.292 174.951 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -97.17 -29.28 13.68 Favored 'General case' 0 CA--C 1.576 1.964 0 C-N-CA 125.152 1.381 . . . . 0.0 114.224 173.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 5.3 m -80.78 159.31 25.19 Favored 'General case' 0 CA--C 1.574 1.87 0 N-CA-C 115.081 1.511 . . . . 0.0 115.081 -179.521 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.7 mptt -63.51 -57.31 10.59 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 120.843 -1.161 . . . . 0.0 108.906 170.717 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.8 t -82.02 104.19 12.2 Favored 'General case' 0 CA--C 1.565 1.548 0 N-CA-C 104.537 -2.394 . . . . 0.0 104.537 170.166 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -68.59 82.31 0.27 Allowed 'General case' 0 N--CA 1.5 2.056 0 CA-C-O 124.411 2.053 . . . . 0.0 113.445 -172.89 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 49.7 t -160.7 87.17 0.74 Allowed 'General case' 0 CA--C 1.558 1.272 0 CA-C-N 112.499 -2.137 . . . . 0.0 111.421 -177.284 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 37.1 t -79.16 110.7 14.67 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 102.911 -2.996 . . . . 0.0 102.911 170.557 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.69 112.82 24.9 Favored 'General case' 0 CA--C 1.557 1.218 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -170.384 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.6 t-80 -81.02 141.18 34.65 Favored 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 124.822 1.249 . . . . 0.0 113.126 -175.702 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.2 p-10 -69.45 17.32 0.05 OUTLIER 'General case' 0 CA--C 1.591 2.558 0 N-CA-C 117.753 2.501 . . . . 0.0 117.753 172.412 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.275 43.0 p 74.75 97.59 0.07 Allowed 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 127.216 2.206 . . . . 0.0 112.402 176.683 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.276 37.3 mm 75.12 -49.98 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.387 0 C-N-CA 125.464 1.506 . . . . 0.0 115.014 174.775 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.258 0.5 OUTLIER -76.9 -121.82 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.143 0 CA-C-N 122.551 2.432 . . . . 0.0 112.965 -179.223 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 82.9 p -159.72 102.09 1.5 Allowed 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 123.943 3.065 . . . . 0.0 117.167 179.964 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 tt -164.39 105.76 0.87 Allowed 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 102.802 -3.036 . . . . 0.0 102.802 173.307 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.6 m -121.13 122.7 40.58 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.865 0.84 . . . . 0.0 112.313 -173.666 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -138.22 136.38 36.52 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 123.94 0.896 . . . . 0.0 110.627 -174.312 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 67.1 m -61.5 146.26 49.18 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 119.906 -1.746 . . . . 0.0 114.839 -177.48 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -142.74 169.58 17.3 Favored 'General case' 0 CA--C 1.567 1.601 0 CA-C-O 123.663 1.697 . . . . 0.0 115.028 -174.514 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -91.07 167.9 12.03 Favored 'General case' 0 CA--C 1.573 1.835 0 CA-C-N 114.329 -1.305 . . . . 0.0 111.459 173.89 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.9 158.5 25.08 Favored 'General case' 0 CA--C 1.584 2.27 0 O-C-N 120.344 -1.472 . . . . 0.0 113.467 174.492 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.49 166.94 22.68 Favored 'General case' 0 CA--C 1.572 1.822 0 O-C-N 120.236 -1.54 . . . . 0.0 113.161 177.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -96.54 163.11 13.17 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.553 -1.342 . . . . 0.0 112.895 -174.408 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -63.89 129.08 38.62 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.337 0.589 . . . . 0.0 111.083 177.364 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 79.81 14.95 0.9 Allowed 'General case' 0 N--CA 1.509 2.477 0 C-N-CA 125.069 1.348 . . . . 0.0 113.758 -171.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 27.2 t -113.88 160.14 19.09 Favored 'General case' 0 CA--C 1.566 1.578 0 O-C-N 120.385 -1.447 . . . . 0.0 111.887 174.73 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 65.8 mt-10 -70.85 116.81 11.58 Favored 'General case' 0 CA--C 1.571 1.771 0 CA-C-O 122.925 1.345 . . . . 0.0 113.729 -175.69 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 15.5 p -124.04 160.5 27.55 Favored 'General case' 0 CA--C 1.568 1.644 0 CA-C-N 113.987 -1.461 . . . . 0.0 113.812 177.766 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.6 t -134.22 123.81 24.92 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 105.363 -2.088 . . . . 0.0 105.363 171.775 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.96 62.82 3.49 Favored 'General case' 0 CA--C 1.565 1.557 0 N-CA-C 115.915 1.821 . . . . 0.0 115.915 -173.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.13 141.62 25.38 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 118.742 2.867 . . . . 0.0 118.742 -172.485 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 64.8 p -141.74 147.87 38.09 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 123.396 1.57 . . . . 0.0 108.834 172.201 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -134.59 -124.25 0.16 Allowed 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 174.598 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -132.61 57.97 1.78 Allowed 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 173.476 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -169.93 -172.48 36.49 Favored Glycine 0 N--CA 1.487 2.037 0 N-CA-C 115.584 0.994 . . . . 0.0 115.584 -173.396 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.3 t -81.45 143.42 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 CA-C-O 122.233 1.016 . . . . 0.0 111.808 -172.569 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -119.33 139.89 51.22 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-O 121.909 0.862 . . . . 0.0 112.6 -173.36 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -74.64 -6.39 48.39 Favored 'General case' 0 CA--C 1.589 2.478 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 174.181 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.62 127.36 3.17 Favored 'General case' 0 CA--C 1.568 1.64 0 C-N-CA 127.302 2.241 . . . . 0.0 106.454 -174.292 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.0 m -68.29 133.57 91.33 Favored Pre-proline 0 CA--C 1.587 2.374 0 O-C-N 119.705 -1.872 . . . . 0.0 112.537 174.124 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -52.31 -0.72 0.06 OUTLIER 'Trans proline' 0 CA--C 1.57 2.279 1 N-CA-C 123.877 4.53 . . . . 0.0 123.877 -174.761 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 73.37 -40.34 0.46 Allowed 'General case' 0 N--CA 1.503 2.186 0 N-CA-C 119.019 2.97 . . . . 0.0 119.019 174.205 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.269 15.2 pt-20 -89.2 59.53 4.95 Favored 'General case' 0 CA--C 1.555 1.151 1 N-CA-C 125.568 5.396 . . . . 0.0 125.568 -172.118 . . . . . . . . 3 2 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.2 mtm105 -88.68 87.81 7.39 Favored 'General case' 0 N--CA 1.501 2.103 0 N-CA-C 104.959 -2.237 . . . . 0.0 104.959 168.001 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 78.8 25.25 60.65 Favored Glycine 0 CA--C 1.568 3.376 0 N-CA-C 116.705 1.442 . . . . 0.0 116.705 -170.943 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . 0.272 4.9 tt -142.13 -162.37 1.39 Allowed 'General case' 0 CA--C 1.581 2.143 0 C-N-CA 125.346 1.458 . . . . 0.0 109.576 -176.283 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -140.06 138.57 35.48 Favored 'General case' 0 CA--C 1.578 2.052 0 O-C-N 118.688 -2.507 . . . . 0.0 110.744 174.229 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 43.4 t -93.05 123.63 36.44 Favored 'General case' 0 CA--C 1.568 1.64 0 O-C-N 121.261 -0.899 . . . . 0.0 108.602 170.832 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -94.51 74.82 3.81 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.138 -1.601 . . . . 0.0 110.378 179.433 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -105.78 72.31 0.22 Allowed Glycine 0 N--CA 1.489 2.209 0 N-CA-C 115.39 0.916 . . . . 0.0 115.39 -176.158 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -71.8 -46.21 59.0 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 178.661 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -156.23 -80.62 0.08 Allowed 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 106.06 -1.83 . . . . 0.0 106.06 174.322 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 76.5 p -141.78 69.74 1.33 Allowed 'General case' 0 CA--C 1.567 1.598 0 O-C-N 121.482 -0.761 . . . . 0.0 112.794 175.14 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -89.66 77.46 7.14 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 172.355 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.8 p -96.34 -45.72 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 N-CA-C 118.156 2.65 . . . . 0.0 118.156 -170.396 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 83.55 -77.41 2.12 Favored Glycine 0 N--CA 1.494 2.509 0 O-C-N 120.998 -1.064 . . . . 0.0 113.418 -174.383 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.3 t -91.96 101.14 13.7 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 170.223 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.0 pp -52.89 143.15 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.779 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 -173.748 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 40.1 p -128.69 171.46 12.17 Favored 'General case' 0 N--CA 1.495 1.802 0 CA-C-N 112.337 -2.211 . . . . 0.0 111.576 -176.544 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -63.57 -16.31 60.49 Favored 'General case' 0 CA--C 1.582 2.203 0 N-CA-C 118.133 2.642 . . . . 0.0 118.133 177.436 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . 0.303 2.1 t -130.8 -110.28 0.26 Allowed 'General case' 0 CA--C 1.57 1.731 0 CA-C-N 121.243 1.838 . . . . 0.0 110.087 -175.162 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -160.2 106.16 1.55 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.293 -1.504 . . . . 0.0 111.757 -173.622 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -127.59 156.96 41.44 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.986 -1.072 . . . . 0.0 113.837 -176.238 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -106.17 -165.04 22.99 Favored Glycine 0 N--CA 1.492 2.426 0 C-N-CA 123.572 0.605 . . . . 0.0 113.941 173.547 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 34.0 mm -121.56 142.79 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.251 0 CA-C-O 122.472 1.129 . . . . 0.0 110.429 178.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 82.8 m -67.91 118.09 10.66 Favored 'General case' 0 CA--C 1.57 1.714 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 174.033 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -142.64 139.62 31.32 Favored 'General case' 0 N--CA 1.483 1.175 0 O-C-N 120.548 -1.345 . . . . 0.0 107.879 173.853 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -94.41 70.6 3.7 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 123.949 1.833 . . . . 0.0 112.027 -175.9 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.5 m -109.59 -42.32 5.21 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.691 0 CA-C-N 112.667 -2.061 . . . . 0.0 113.947 -175.265 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -80.45 -18.58 70.81 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 119.263 2.465 . . . . 0.0 119.263 174.849 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -86.15 80.0 8.93 Favored 'General case' 0 CA--C 1.572 1.816 0 CA-C-N 119.839 1.82 . . . . 0.0 111.73 179.1 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 42.4 m . . . . . 0 N--CA 1.504 2.25 0 N-CA-C 115.843 1.794 . . . . 0.0 115.843 -178.881 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.257 9.2 p . . . . . 0 CA--C 1.586 2.353 0 CA-C-O 114.797 -2.525 . . . . 0.0 116.311 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -76.24 96.75 1.08 Allowed 'Trans proline' 0 CA--C 1.571 2.329 0 CA-C-N 127.647 3.767 . . . . 0.0 113.016 178.464 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -104.47 93.99 6.53 Favored Pre-proline 0 CA--C 1.581 2.135 0 CA-C-O 117.746 -1.121 . . . . 0.0 112.183 -174.762 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -74.83 104.96 1.98 Allowed 'Trans proline' 0 CA--C 1.568 2.215 0 C-N-CA 122.642 2.228 . . . . 0.0 113.366 177.032 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.7 tpm_? -70.08 -29.01 65.9 Favored 'General case' 0 CA--C 1.578 2.023 0 N-CA-C 117.234 2.309 . . . . 0.0 117.234 -175.66 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -79.68 72.48 2.55 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 117.507 1.763 . . . . 0.0 117.507 -179.564 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 49.8 mm -98.38 -66.84 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 C-N-CA 123.995 0.918 . . . . 0.0 109.332 -179.229 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.9 mm -106.1 -59.12 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.261 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 173.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 31.7 pt -102.63 177.3 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.575 1.916 0 CA-C-N 119.531 1.059 . . . . 0.0 110.122 173.071 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 63.53 57.72 1.43 Allowed 'General case' 0 CA--C 1.582 2.18 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 pp -128.44 169.22 14.56 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 116.022 1.86 . . . . 0.0 116.022 -174.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -75.0 169.77 17.34 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 115.702 1.741 . . . . 0.0 115.702 -173.026 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -75.08 153.36 38.39 Favored 'General case' 0 CA--C 1.575 1.931 0 CA-C-O 122.253 1.025 . . . . 0.0 112.452 176.921 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 92.43 23.29 26.95 Favored Glycine 0 N--CA 1.496 2.643 0 N-CA-C 116.706 1.442 . . . . 0.0 116.706 -173.066 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 -135.62 142.87 45.29 Favored 'General case' 0 CA--C 1.569 1.676 0 C-N-CA 124.773 1.229 . . . . 0.0 110.805 -177.917 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.4 tp -77.9 142.21 38.57 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -174.844 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.9 p -131.88 -178.58 4.95 Favored 'General case' 0 CA--C 1.575 1.936 0 CA-C-O 123.106 1.431 . . . . 0.0 114.601 -176.201 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.9 mt -107.79 -74.59 0.65 Allowed 'General case' 0 CA--C 1.574 1.902 0 N-CA-C 104.851 -2.277 . . . . 0.0 104.851 170.603 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -95.86 -168.59 1.79 Allowed 'General case' 0 CA--C 1.587 2.384 0 CA-C-N 119.986 1.266 . . . . 0.0 113.345 171.758 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.0 m -90.15 -9.47 48.15 Favored 'General case' 0 N--CA 1.507 2.425 0 N-CA-C 117.034 2.235 . . . . 0.0 117.034 174.291 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.73 10.35 2.26 Favored 'General case' 0 CA--C 1.577 2.005 0 N-CA-C 117.395 2.368 . . . . 0.0 117.395 175.24 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -94.2 -29.88 14.88 Favored 'General case' 0 CA--C 1.569 1.693 0 C-N-CA 124.807 1.243 . . . . 0.0 113.821 176.866 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . 0.259 80.4 m -81.99 -172.72 4.09 Favored 'General case' 0 CA--C 1.585 2.314 0 CA-C-N 121.866 2.121 . . . . 0.0 111.382 173.035 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -56.11 -69.87 0.13 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 119.345 -2.097 . . . . 0.0 116.646 -172.014 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.0 t -86.86 -72.51 0.5 Allowed 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 122.053 0.93 . . . . 0.0 111.443 174.315 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -172.17 63.96 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.937 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.63 -174.017 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 37.5 t -139.74 71.84 1.39 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 119.368 -2.082 . . . . 0.0 116.378 -173.731 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.3 t -98.03 123.86 42.25 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 170.637 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -103.23 120.3 40.48 Favored 'General case' 0 CA--C 1.573 1.835 0 CA-C-O 122.956 1.36 . . . . 0.0 114.053 -172.456 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -86.07 133.37 33.9 Favored 'General case' 0 CA--C 1.562 1.422 0 C-N-CA 125.322 1.449 . . . . 0.0 112.389 -177.482 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -82.69 59.04 4.53 Favored 'General case' 0 CA--C 1.58 2.119 0 O-C-N 120.63 -1.294 . . . . 0.0 114.39 173.935 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.256 6.0 t 48.38 88.55 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.316 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 175.857 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.3 4.2 mp 73.92 -57.57 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.633 0 C-N-CA 125.419 1.488 . . . . 0.0 111.325 -178.734 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.0 mt -62.29 114.28 3.38 Favored 'General case' 0 N--CA 1.496 1.873 0 CA-C-N 120.833 1.651 . . . . 0.0 109.572 173.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.0 p -85.46 50.04 1.88 Allowed 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 120.257 3.429 . . . . 0.0 120.257 -171.135 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.3 tt -92.37 85.92 5.53 Favored 'General case' 0 N--CA 1.498 1.955 0 N-CA-C 101.799 -3.408 . . . . 0.0 101.799 169.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 51.0 m -94.75 109.59 21.53 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 122.464 1.126 . . . . 0.0 112.889 -170.545 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 29.9 ttt85 -123.94 135.5 53.71 Favored 'General case' 0 CA--C 1.562 1.414 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.267 -175.357 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 95.1 m -65.65 145.15 56.39 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 123.779 1.752 . . . . 0.0 114.103 -179.695 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -138.09 -173.08 3.42 Favored 'General case' 0 CA--C 1.566 1.564 0 CA-C-N 113.535 -1.666 . . . . 0.0 112.887 -174.177 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 pp -80.62 151.51 28.99 Favored 'General case' 0 CA--C 1.572 1.791 0 CA-C-O 122.86 1.314 . . . . 0.0 113.506 175.395 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.1 pttt -80.94 143.27 32.74 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 123.616 0.766 . . . . 0.0 110.591 173.66 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.01 152.68 38.7 Favored 'General case' 0 CA--C 1.568 1.669 0 N-CA-C 118.108 2.633 . . . . 0.0 118.108 -171.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -102.7 170.23 8.14 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 113.141 -1.845 . . . . 0.0 112.683 -178.533 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -50.18 130.11 22.18 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 115.176 1.547 . . . . 0.0 115.176 -174.727 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 69.32 31.63 3.82 Favored 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -173.35 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 43.4 m -129.8 153.76 47.92 Favored 'General case' 0 CA--C 1.566 1.583 0 CA-C-O 122.763 1.268 . . . . 0.0 111.345 174.98 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -74.72 115.0 13.81 Favored 'General case' 0 CA--C 1.571 1.769 0 CA-C-O 123.462 1.601 . . . . 0.0 113.537 -176.579 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 13.7 p -111.18 152.75 26.69 Favored 'General case' 0 CA--C 1.562 1.439 0 CA-C-N 113.596 -1.638 . . . . 0.0 112.229 174.57 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.9 m -77.46 108.36 10.57 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.363 -1.461 . . . . 0.0 107.546 174.292 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.94 -54.43 7.24 Favored 'General case' 0 CA--C 1.564 1.497 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -172.557 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -93.28 138.32 31.76 Favored 'General case' 0 CA--C 1.565 1.531 0 CA-C-N 118.582 0.628 . . . . 0.0 109.508 173.641 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.8 p -110.34 142.32 42.15 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 123.441 1.591 . . . . 0.0 111.901 178.138 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.72 -144.03 0.3 Allowed 'General case' 0 CA--C 1.568 1.664 0 CA-C-N 113.203 -1.817 . . . . 0.0 108.902 174.115 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -121.21 75.38 1.16 Allowed 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 103.729 -2.693 . . . . 0.0 103.729 171.474 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 174.32 -162.35 32.66 Favored Glycine 0 N--CA 1.485 1.934 0 CA-C-O 122.908 1.282 . . . . 0.0 116.295 -174.549 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.6 t -79.29 145.51 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 CA-C-O 122.841 1.305 . . . . 0.0 111.336 -176.032 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -115.35 138.78 50.61 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.016 -173.845 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -66.06 -30.83 71.42 Favored 'General case' 0 CA--C 1.587 2.386 0 O-C-N 120.034 -1.667 . . . . 0.0 115.332 -176.164 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.5 mtmm -153.82 113.49 3.83 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 102.902 -2.999 . . . . 0.0 102.902 172.794 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 67.9 m -39.85 150.23 0.26 Allowed Pre-proline 0 CA--C 1.599 2.837 0 N-CA-C 119.919 3.303 . . . . 0.0 119.919 -173.521 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -69.1 58.46 1.24 Allowed 'Trans proline' 0 CA--C 1.579 2.765 0 N-CA-C 121.674 3.682 . . . . 0.0 121.674 -173.822 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 3.4 t 61.34 162.7 0.07 Allowed 'General case' 0 CA--C 1.582 2.201 0 N-CA-C 117.823 2.527 . . . . 0.0 117.823 174.182 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -75.63 160.37 30.17 Favored 'General case' 0 CA--C 1.574 1.888 0 N-CA-C 115.494 1.665 . . . . 0.0 115.494 178.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -63.23 120.35 11.37 Favored 'General case' 0 CA--C 1.572 1.818 0 CA-C-O 122.553 1.168 . . . . 0.0 113.073 -179.111 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.19 -28.26 15.91 Favored Glycine 0 N--CA 1.498 2.81 0 N-CA-C 116.846 1.498 . . . . 0.0 116.846 -173.219 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.4 mp -98.65 144.9 27.42 Favored 'General case' 0 CA--C 1.565 1.539 0 CA-C-O 122.412 1.101 . . . . 0.0 111.944 -179.128 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.78 153.59 18.64 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 122.083 0.944 . . . . 0.0 112.489 -178.708 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 5.1 t -92.77 96.52 10.2 Favored 'General case' 0 CA--C 1.57 1.719 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.825 174.717 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -97.77 103.63 15.58 Favored 'General case' 0 CA--C 1.57 1.738 0 O-C-N 120.436 -1.415 . . . . 0.0 113.431 -173.966 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 154.94 -56.77 0.41 Allowed Glycine 0 N--CA 1.499 2.87 0 N-CA-C 118.994 2.358 . . . . 0.0 118.994 174.933 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 67.98 -19.5 0.14 Allowed 'General case' 0 CA--C 1.582 2.177 0 N-CA-C 118.767 2.877 . . . . 0.0 118.767 -174.961 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -142.43 122.04 13.35 Favored 'General case' 0 CA--C 1.567 1.628 0 CA-C-N 120.482 1.492 . . . . 0.0 109.651 175.271 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.8 t -92.15 86.92 5.93 Favored 'General case' 0 CA--C 1.56 1.354 0 O-C-N 120.759 -1.213 . . . . 0.0 111.413 -177.774 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 28.4 tp -57.65 -36.25 71.62 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 174.756 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 82.0 t -81.1 72.68 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.585 2.323 0 CA-C-O 122.942 1.353 . . . . 0.0 107.406 172.696 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 129.04 37.12 0.4 Allowed Glycine 0 CA--C 1.556 2.628 0 N-CA-C 116.488 1.355 . . . . 0.0 116.488 -173.45 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.9 m -95.77 74.05 3.13 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 119.519 1.66 . . . . 0.0 113.08 179.268 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.6 mp -110.13 -64.49 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 N-CA-C 105.536 -2.024 . . . . 0.0 105.536 173.689 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.4 p -84.06 -172.23 4.05 Favored 'General case' 0 CA--C 1.576 1.943 0 CA-C-O 122.863 1.316 . . . . 0.0 111.272 172.87 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -71.18 70.23 0.55 Allowed 'General case' 0 CA--C 1.575 1.935 0 O-C-N 120.291 -1.505 . . . . 0.0 112.713 174.899 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 41.0 p -97.87 71.55 2.2 Favored 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 125.999 2.809 . . . . 0.0 110.769 -174.83 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -90.72 72.84 6.7 Favored 'General case' 0 CA--C 1.566 1.569 0 CA-C-N 111.049 -2.796 . . . . 0.0 110.59 -176.099 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -125.94 149.93 48.38 Favored 'General case' 0 CA--C 1.559 1.327 0 N-CA-C 115.528 1.677 . . . . 0.0 115.528 -172.974 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -108.12 166.75 13.09 Favored Glycine 0 CA--C 1.548 2.154 0 CA-C-N 113.596 -1.638 . . . . 0.0 109.443 170.055 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 38.2 mm -102.37 135.59 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 120.23 -1.747 . . . . 0.0 109.322 179.019 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 28.6 m -62.98 119.52 9.6 Favored 'General case' 0 CA--C 1.572 1.791 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 174.235 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -139.58 153.63 47.43 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 122.452 1.12 . . . . 0.0 109.775 174.902 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -94.22 69.6 3.75 Favored 'General case' 0 N--CA 1.496 1.858 0 CA-C-O 124.02 1.867 . . . . 0.0 115.688 -172.272 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.4 t -82.37 -40.07 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 CA-C-N 112.89 -1.959 . . . . 0.0 112.572 174.752 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -72.87 -1.13 54.38 Favored Glycine 0 N--CA 1.498 2.787 0 N-CA-C 120.592 2.997 . . . . 0.0 120.592 174.85 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 35.7 ttp-105 -129.95 -71.9 0.59 Allowed 'General case' 0 CA--C 1.568 1.639 0 CA-C-N 119.483 1.642 . . . . 0.0 109.196 172.83 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 92.0 p . . . . . 0 N--CA 1.493 1.709 0 CA-C-O 124.222 1.963 . . . . 0.0 112.657 176.271 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.256 9.3 p . . . . . 0 CA--C 1.587 2.387 0 CA-C-O 114.507 -2.663 . . . . 0.0 115.898 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -74.81 75.9 3.47 Favored 'Trans proline' 0 CA--C 1.574 2.524 0 CA-C-N 127.539 3.728 . . . . 0.0 115.453 179.722 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 60.89 69.74 1.05 Allowed Pre-proline 0 CA--C 1.589 2.448 0 C-N-CA 125.441 1.496 . . . . 0.0 113.676 -174.738 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -86.78 155.69 8.8 Favored 'Trans proline' 0 CA--C 1.567 2.157 0 C-N-CA 122.403 2.069 . . . . 0.0 115.554 -176.147 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -84.3 70.33 10.59 Favored 'General case' 0 CA--C 1.577 1.998 0 CA-C-O 122.75 1.262 . . . . 0.0 110.73 174.248 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 161.54 100.31 0.15 Allowed Glycine 0 N--CA 1.486 1.989 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.513 -174.492 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 63.7 mt -87.84 80.03 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 CA-C-O 122.533 1.159 . . . . 0.0 108.62 -175.075 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 1.8 pp -85.34 54.98 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.36 0 N-CA-C 114.841 1.422 . . . . 0.0 114.841 -174.891 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.4 pt -122.4 -146.54 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.581 2.145 0 O-C-N 120.695 -1.253 . . . . 0.0 110.407 -179.308 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 63.37 67.05 0.67 Allowed 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 178.94 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -122.11 151.18 41.2 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 123.866 1.794 . . . . 0.0 115.61 -179.214 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -83.0 166.46 18.79 Favored 'General case' 0 CA--C 1.572 1.819 0 CA-C-N 114.503 -1.226 . . . . 0.0 112.59 173.931 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.44 149.18 33.3 Favored 'General case' 0 CA--C 1.578 2.029 0 O-C-N 120.658 -1.276 . . . . 0.0 109.879 173.677 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.8 30.42 18.06 Favored Glycine 0 CA--C 1.559 2.84 0 O-C-N 121.236 -0.915 . . . . 0.0 114.979 -171.724 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -137.27 141.41 41.97 Favored 'General case' 0 CA--C 1.565 1.542 0 C-N-CA 125.024 1.33 . . . . 0.0 109.528 -174.024 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.7 tt -69.63 117.73 11.6 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.906 -1.121 . . . . 0.0 111.785 -179.054 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 39' ' ' CYS . 22.0 p -124.98 155.68 39.26 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 122.083 0.944 . . . . 0.0 113.222 -175.654 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.1 mp -91.4 -77.48 0.42 Allowed 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 173.841 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -92.38 164.9 13.32 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 115.504 1.668 . . . . 0.0 115.504 174.968 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.3 m -70.6 -22.78 62.51 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 116.474 2.028 . . . . 0.0 116.474 175.434 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.89 6.84 5.52 Favored 'General case' 0 CA--C 1.58 2.111 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 173.095 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -91.82 -41.49 10.62 Favored 'General case' 0 CA--C 1.565 1.527 0 C-N-CA 124.67 1.188 . . . . 0.0 111.899 174.148 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 74.4 m -77.41 136.77 38.43 Favored 'General case' 0 CA--C 1.571 1.787 0 CA-C-N 121.082 1.764 . . . . 0.0 110.476 174.05 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -44.58 -37.43 3.58 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 120.976 3.695 . . . . 0.0 120.976 -172.247 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.2 m -80.69 -83.26 0.11 Allowed 'General case' 0 CA--C 1.57 1.718 0 CA-C-N 118.472 0.578 . . . . 0.0 110.361 173.928 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -175.77 31.08 0.0 OUTLIER 'General case' 0 CA--C 1.588 2.431 0 C-N-CA 124.497 1.119 . . . . 0.0 113.138 -178.255 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 36.7 t -134.9 102.24 5.17 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 118.989 2.959 . . . . 0.0 118.989 -170.506 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 49.5 t -106.03 113.42 26.95 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 102.568 -3.123 . . . . 0.0 102.568 169.018 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.15 123.82 42.39 Favored 'General case' 0 CA--C 1.564 1.484 0 CA-C-O 122.059 0.933 . . . . 0.0 112.297 -173.065 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 20.4 t-80 -77.92 165.45 24.08 Favored 'General case' 0 CA--C 1.567 1.63 0 CA-C-O 122.656 1.217 . . . . 0.0 114.052 -174.742 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -80.35 -101.82 0.03 OUTLIER 'General case' 0 CA--C 1.577 2.006 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 172.631 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.1 p -150.77 90.93 1.67 Allowed 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 120.498 1.499 . . . . 0.0 108.112 174.148 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.271 5.9 mt 70.58 -31.6 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.512 2.67 0 N-CA-C 115.943 1.831 . . . . 0.0 115.943 174.603 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.4 tp -76.62 -123.31 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.151 0 CA-C-N 121.724 2.056 . . . . 0.0 111.03 174.938 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.0 p -162.05 92.82 0.86 Allowed 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 122.433 2.379 . . . . 0.0 114.986 178.11 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.0 tp -150.86 83.83 1.34 Allowed 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 104.067 -2.568 . . . . 0.0 104.067 172.746 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.8 m -104.5 131.34 51.99 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 122.646 1.213 . . . . 0.0 112.795 -173.29 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -131.71 134.82 46.32 Favored 'General case' 0 CA--C 1.562 1.419 0 C-N-CA 124.53 1.132 . . . . 0.0 108.951 -178.659 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 17' ' ' CYS . 99.4 m -65.26 146.92 54.32 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 119.874 -1.766 . . . . 0.0 113.9 178.409 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.42 179.73 6.49 Favored 'General case' 0 CA--C 1.564 1.513 0 CA-C-N 113.979 -1.464 . . . . 0.0 114.025 -173.368 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 98.1 mt -81.26 149.25 29.08 Favored 'General case' 0 CA--C 1.568 1.664 0 CA-C-O 122.097 0.951 . . . . 0.0 112.492 176.118 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -75.99 153.38 36.57 Favored 'General case' 0 CA--C 1.573 1.855 0 CA-C-O 121.856 0.836 . . . . 0.0 111.458 173.943 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.61 157.4 31.95 Favored 'General case' 0 CA--C 1.568 1.655 0 N-CA-C 116.856 2.169 . . . . 0.0 116.856 -173.252 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 43.2 mtp180 -117.58 172.03 7.62 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 113.257 -1.792 . . . . 0.0 111.308 179.45 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -48.59 132.46 17.33 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 116.216 1.932 . . . . 0.0 116.216 -172.972 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 m120 72.75 18.42 4.19 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -173.934 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.4 t -114.45 151.71 32.76 Favored 'General case' 0 CA--C 1.567 1.632 0 CA-C-O 123.11 1.433 . . . . 0.0 112.599 176.096 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -76.74 101.79 5.96 Favored 'General case' 0 CA--C 1.57 1.718 0 C-N-CA 124.86 1.264 . . . . 0.0 113.291 -177.706 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.05 156.52 16.89 Favored 'General case' 0 CA--C 1.564 1.493 0 CA-C-O 123.09 1.424 . . . . 0.0 113.793 177.254 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.1 t -82.46 96.9 8.15 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 171.522 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.6 -47.42 40.54 Favored 'General case' 0 CA--C 1.566 1.583 0 N-CA-C 115.926 1.825 . . . . 0.0 115.926 -173.304 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -89.03 153.12 21.26 Favored 'General case' 0 CA--C 1.57 1.746 0 C-N-CA 123.792 0.837 . . . . 0.0 109.547 172.904 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.1 p -126.27 146.74 49.88 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 123.946 1.831 . . . . 0.0 111.86 176.775 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -105.79 -53.0 2.72 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-N 112.869 -1.969 . . . . 0.0 113.355 175.144 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -164.76 -54.45 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.915 0 C-N-CA 127.14 2.176 . . . . 0.0 107.761 -174.875 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 112.01 94.36 2.19 Favored Glycine 0 N--CA 1.474 1.2 0 N-CA-C 116.916 1.526 . . . . 0.0 116.916 174.513 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.6 t -115.79 140.22 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 119.427 -2.219 . . . . 0.0 107.132 110.157 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -116.9 135.86 53.4 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -172.286 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -64.36 -41.48 96.71 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.616 -1.302 . . . . 0.0 113.377 174.23 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -142.2 110.59 6.05 Favored 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 103.549 -2.759 . . . . 0.0 103.549 172.503 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 57.1 m -53.02 161.5 1.22 Allowed Pre-proline 0 CA--C 1.588 2.427 0 N-CA-C 118.262 2.69 . . . . 0.0 118.262 -174.817 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -53.86 172.34 0.27 Allowed 'Trans proline' 0 CA--C 1.573 2.436 0 C-N-CA 122.954 2.436 . . . . 0.0 117.984 174.917 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 63.0 m -71.5 147.33 47.86 Favored 'General case' 0 CA--C 1.569 1.703 0 O-C-N 120.849 -1.157 . . . . 0.0 113.388 174.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -65.46 153.12 42.27 Favored 'General case' 0 CA--C 1.572 1.825 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 179.006 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 38.7 ttp180 -40.42 -35.65 0.46 Allowed 'General case' 0 N--CA 1.507 2.411 0 N-CA-C 121.574 3.916 . . . . 0.0 121.574 -174.606 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.42 -25.06 74.98 Favored Glycine 0 CA--C 1.555 2.551 0 N-CA-C 119.985 2.754 . . . . 0.0 119.985 173.933 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -135.28 169.22 17.81 Favored 'General case' 0 CA--C 1.574 1.883 0 CA-C-N 120.21 2.005 . . . . 0.0 114.159 179.16 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -98.68 158.17 15.79 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 -173.707 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.7 t -94.86 128.3 41.51 Favored 'General case' 0 CA--C 1.57 1.723 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.046 171.451 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -93.19 98.94 11.61 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.006 -1.684 . . . . 0.0 108.152 -178.126 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.01 38.69 0.06 OUTLIER Glycine 0 N--CA 1.498 2.774 1 N-CA-C 124.728 4.651 . . . . 0.0 124.728 -172.979 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -86.35 82.74 7.88 Favored 'General case' 0 CA--C 1.571 1.755 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 164.204 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.35 49.32 0.58 Allowed 'General case' 0 CA--C 1.576 1.978 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -173.592 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.0 t 58.73 -77.07 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 126.918 2.087 . . . . 0.0 115.841 174.752 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 38.0 tp 65.01 -57.54 0.28 Allowed 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 178.269 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 97.3 t -87.13 78.98 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.573 1.854 0 CA-C-O 122.665 1.221 . . . . 0.0 109.576 -176.511 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -158.69 72.61 0.23 Allowed Glycine 0 N--CA 1.491 2.317 0 O-C-N 121.505 -0.747 . . . . 0.0 113.82 179.388 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.2 t 49.46 35.34 7.99 Favored 'General case' 0 N--CA 1.506 2.362 0 N-CA-C 118.257 2.688 . . . . 0.0 118.257 -179.638 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.345 0.2 OUTLIER 44.01 67.83 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.514 2.753 0 CA-C-O 124.449 2.071 . . . . 0.0 114.548 -174.877 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 18.2 p -117.62 163.77 15.96 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-O 124.403 2.049 . . . . 0.0 113.72 -174.476 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -70.16 -0.17 7.32 Favored 'General case' 0 CA--C 1.578 2.054 0 N-CA-C 119.064 2.986 . . . . 0.0 119.064 174.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 76.0 p -98.18 71.73 2.12 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 124.648 2.166 . . . . 0.0 111.411 -175.763 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -96.05 74.16 3.01 Favored 'General case' 0 CA--C 1.568 1.665 0 CA-C-N 111.764 -2.471 . . . . 0.0 110.19 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -121.34 144.95 48.37 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 116.405 2.002 . . . . 0.0 116.405 -172.216 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -107.72 151.03 16.96 Favored Glycine 0 CA--C 1.548 2.125 0 CA-C-N 114.458 -1.246 . . . . 0.0 111.19 173.453 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 24.7 mm -92.52 134.91 29.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 120.099 -1.824 . . . . 0.0 110.583 -166.464 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 98.8 m -63.98 123.59 19.39 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 175.013 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -143.73 151.63 40.27 Favored 'General case' 0 CA--C 1.563 1.449 0 CA-C-O 123.612 1.672 . . . . 0.0 110.532 174.875 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -98.08 79.72 2.63 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 124.422 2.058 . . . . 0.0 111.26 -176.071 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.9 t -105.72 74.16 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.707 0 CA-C-N 112.012 -2.358 . . . . 0.0 108.056 -175.636 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -79.91 58.51 4.54 Favored Glycine 0 N--CA 1.497 2.706 0 N-CA-C 116.727 1.451 . . . . 0.0 116.727 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 -93.71 82.67 4.34 Favored 'General case' 0 CA--C 1.569 1.692 0 CA-C-O 122.293 1.045 . . . . 0.0 111.253 -176.49 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.9 t . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 124.022 1.867 . . . . 0.0 114.303 -175.85 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 . . . . . 0 CA--C 1.579 2.093 0 N-CA-C 116.96 2.207 . . . . 0.0 116.96 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mt -132.42 152.51 51.46 Favored 'General case' 0 N--CA 1.5 2.068 0 CA-C-O 123.695 1.712 . . . . 0.0 113.269 173.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -83.81 163.51 20.1 Favored 'General case' 0 CA--C 1.571 1.752 0 CA-C-N 114.375 -1.284 . . . . 0.0 113.612 177.143 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.77 137.79 38.64 Favored 'General case' 0 CA--C 1.579 2.062 0 O-C-N 120.867 -1.146 . . . . 0.0 108.011 172.363 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.33 1.22 44.19 Favored Glycine 0 CA--C 1.56 2.889 0 N-CA-C 115.866 1.106 . . . . 0.0 115.866 -171.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -113.34 149.81 33.48 Favored 'General case' 0 CA--C 1.572 1.807 0 CA-C-N 118.951 1.375 . . . . 0.0 110.283 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.4 tt -69.45 128.12 35.42 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 120.824 -1.172 . . . . 0.0 112.87 -176.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.9 p -128.97 151.78 49.31 Favored 'General case' 0 CA--C 1.562 1.404 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -177.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.9 mt -85.84 -81.5 0.21 Allowed 'General case' 0 CA--C 1.567 1.6 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 173.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -94.53 177.76 5.82 Favored 'General case' 0 N--CA 1.499 1.981 0 CA-C-N 119.311 0.959 . . . . 0.0 112.57 173.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -71.0 -6.19 36.99 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 173.559 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.31 7.18 4.56 Favored 'General case' 0 CA--C 1.571 1.771 0 N-CA-C 117.128 2.27 . . . . 0.0 117.128 172.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -91.72 -51.2 5.35 Favored 'General case' 0 CA--C 1.567 1.607 0 C-N-CA 124.116 0.966 . . . . 0.0 111.97 -177.047 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 80.0 m -82.6 147.69 28.44 Favored 'General case' 0 CA--C 1.558 1.267 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -53.56 -53.7 47.98 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 124.039 0.936 . . . . 0.0 111.082 173.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 65.3 m -83.27 104.31 13.33 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 103.568 -2.753 . . . . 0.0 103.568 168.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.87 80.42 0.46 Allowed 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 124.998 2.332 . . . . 0.0 114.624 -172.743 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.0 t -142.54 72.97 1.39 Allowed 'General case' 0 CA--C 1.56 1.352 0 CA-C-N 112.291 -2.231 . . . . 0.0 110.076 -174.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 34.6 t -78.74 111.38 14.8 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 104.746 -2.316 . . . . 0.0 104.746 172.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -100.42 115.62 30.45 Favored 'General case' 0 CA--C 1.567 1.627 0 CA-C-O 122.997 1.38 . . . . 0.0 114.332 -170.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.605 ' HB2' HG12 ' A' ' 57' ' ' VAL . 15.5 t-80 -82.19 158.22 23.67 Favored 'General case' 0 CA--C 1.566 1.583 0 C-N-CA 126.047 1.739 . . . . 0.0 113.238 -178.103 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.3 -55.56 32.19 Favored 'General case' 0 CA--C 1.583 2.228 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 174.758 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.6 t 175.29 -38.88 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.518 0 C-N-CA 125.794 1.638 . . . . 0.0 111.838 -174.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 6.0 tp -157.28 -46.33 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.225 0 CA-C-N 119.95 1.25 . . . . 0.0 113.272 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.6 mt -77.07 -83.44 0.07 Allowed 'General case' 0 N--CA 1.497 1.888 0 CA-C-N 120.708 1.595 . . . . 0.0 112.91 -174.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 96.3 p -154.89 -123.65 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 121.332 1.878 . . . . 0.0 112.934 174.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.1 tt 53.96 80.72 0.11 Allowed 'General case' 0 N--CA 1.503 2.181 0 CA-C-N 120.325 1.42 . . . . 0.0 110.944 -173.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.5 m -117.06 107.65 14.78 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 122.947 1.356 . . . . 0.0 111.262 -174.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 20.7 ttp180 -125.93 141.37 52.01 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.682 1.193 . . . . 0.0 108.616 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 91.1 m -67.08 147.61 52.94 Favored 'General case' 0 CA--C 1.561 1.394 0 O-C-N 119.656 -1.903 . . . . 0.0 114.586 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.14 -177.82 5.18 Favored 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 113.262 -1.79 . . . . 0.0 112.303 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 35.5 tp -85.68 142.95 28.67 Favored 'General case' 0 CA--C 1.571 1.756 0 O-C-N 120.987 -1.071 . . . . 0.0 112.66 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -72.42 143.96 48.33 Favored 'General case' 0 CA--C 1.575 1.937 0 O-C-N 121.497 -0.752 . . . . 0.0 110.186 173.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.26 152.18 36.57 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 118.611 2.819 . . . . 0.0 118.611 -171.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.9 mmt180 -121.48 175.74 6.04 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-N 111.522 -2.581 . . . . 0.0 111.732 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -57.84 127.56 32.67 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -173.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 76.39 29.59 0.7 Allowed 'General case' 0 N--CA 1.504 2.268 0 C-N-CA 125.194 1.398 . . . . 0.0 113.593 -172.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.6 t -124.85 149.6 47.31 Favored 'General case' 0 CA--C 1.566 1.581 0 O-C-N 120.485 -1.385 . . . . 0.0 112.123 175.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -77.85 104.76 8.6 Favored 'General case' 0 CA--C 1.572 1.791 0 CA-C-O 123.533 1.635 . . . . 0.0 113.207 -177.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -101.22 167.58 10.11 Favored 'General case' 0 CA--C 1.575 1.911 0 C-N-CA 125.901 1.68 . . . . 0.0 111.794 173.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.0 t -86.51 -86.7 0.14 Allowed 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 104.984 -2.228 . . . . 0.0 104.984 170.023 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -156.34 -74.51 0.1 Allowed 'General case' 0 CA--C 1.565 1.557 0 CA-C-N 120.513 1.506 . . . . 0.0 112.606 172.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 23.3 p90 -137.58 177.53 7.8 Favored 'General case' 0 CA--C 1.574 1.875 0 C-N-CA 124.013 0.925 . . . . 0.0 111.548 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.1 p -87.89 135.22 33.49 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.599 -1.313 . . . . 0.0 113.634 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.588 HD12 ' H ' ' A' ' 55' ' ' TYR . 1.0 OUTLIER -100.98 -121.49 0.16 Allowed 'General case' 0 CA--C 1.566 1.563 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 172.533 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.588 ' H ' HD12 ' A' ' 54' ' ' LEU . 60.3 t80 -144.64 74.36 1.41 Allowed 'General case' 0 CA--C 1.57 1.732 0 N-CA-C 103.663 -2.717 . . . . 0.0 103.663 171.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 168.2 -171.57 42.54 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 116.217 1.247 . . . . 0.0 116.217 -174.676 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.605 HG12 ' HB2' ' A' ' 30' ' ' HIS . 4.4 t -77.65 142.29 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 CA-C-O 122.779 1.276 . . . . 0.0 111.103 -172.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -115.37 126.55 54.55 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.075 -172.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -59.61 -40.99 89.37 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 175.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -142.49 113.24 7.42 Favored 'General case' 0 CA--C 1.56 1.365 0 N-CA-C 102.891 -3.003 . . . . 0.0 102.891 171.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 59.0 m -52.02 144.14 21.61 Favored Pre-proline 0 CA--C 1.586 2.358 0 N-CA-C 115.796 1.776 . . . . 0.0 115.796 -177.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -68.26 179.62 2.81 Favored 'Trans proline' 0 CA--C 1.568 2.187 0 C-N-CA 122.284 1.989 . . . . 0.0 116.411 -174.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 56.7 m -74.06 149.03 41.4 Favored 'General case' 0 CA--C 1.573 1.84 0 O-C-N 121.029 -1.044 . . . . 0.0 112.682 174.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.51 176.51 2.85 Favored 'General case' 0 CA--C 1.583 2.233 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 177.25 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.4 113.66 4.26 Favored 'General case' 0 CA--C 1.579 2.062 0 O-C-N 119.866 -1.771 . . . . 0.0 112.983 178.275 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 122.49 -39.11 2.36 Favored Glycine 0 N--CA 1.497 2.737 0 CA-C-N 113.923 -1.49 . . . . 0.0 116.079 -173.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 mp -98.4 151.77 20.2 Favored 'General case' 0 CA--C 1.567 1.604 0 CA-C-O 122.732 1.253 . . . . 0.0 112.704 -177.184 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -111.23 151.83 27.82 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.158 -0.964 . . . . 0.0 111.407 -179.424 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 4.0 t -90.65 117.76 29.56 Favored 'General case' 0 CA--C 1.569 1.685 0 C-N-CA 122.827 0.451 . . . . 0.0 111.991 175.143 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 . . . . . 0 N--CA 1.496 1.839 0 O-C-N 120.617 -1.302 . . . . 0.0 109.86 -176.715 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 123.3 1.524 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -153.71 168.25 32.21 Favored Glycine 0 N--CA 1.48 1.59 0 CA-C-N 115.246 -0.888 . . . . 0.0 114.735 -175.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 23.8 mm -97.9 132.43 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.15 -1.206 . . . . 0.0 109.577 -176.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.2 m -67.12 125.83 27.25 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 174.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -143.23 158.95 43.17 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 123.105 1.431 . . . . 0.0 111.832 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -93.81 74.66 4.25 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 123.54 1.638 . . . . 0.0 111.511 -174.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 N--CA 1.504 2.253 0 CA-C-N 113.693 -1.594 . . . . 0.0 115.048 -176.782 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.576 1.973 0 N-CA-C 116.959 2.207 . . . . 0.0 116.959 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.2 tp -159.39 125.15 4.29 Favored 'General case' 0 CA--C 1.579 2.091 0 N-CA-C 105.744 -1.947 . . . . 0.0 105.744 173.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -80.44 165.52 22.12 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 118.874 -2.391 . . . . 0.0 113.486 -175.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.17 144.01 44.99 Favored 'General case' 0 CA--C 1.576 1.974 0 O-C-N 120.962 -1.086 . . . . 0.0 110.037 174.66 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.79 25.06 26.1 Favored Glycine 0 CA--C 1.563 3.042 0 N-CA-C 114.769 0.668 . . . . 0.0 114.769 -171.026 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -136.15 148.4 48.18 Favored 'General case' 0 CA--C 1.571 1.762 0 C-N-CA 125.462 1.505 . . . . 0.0 109.132 -178.195 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 tt -69.1 117.75 11.14 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.59 -1.319 . . . . 0.0 112.284 -176.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 26.5 p -117.42 152.88 34.08 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 121.797 0.808 . . . . 0.0 113.054 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.0 mp -89.87 -78.72 0.36 Allowed 'General case' 0 CA--C 1.568 1.64 0 N-CA-C 106.348 -1.723 . . . . 0.0 106.348 172.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -96.46 168.86 10.29 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 120.59 1.541 . . . . 0.0 114.512 174.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.5 t -70.25 -21.93 62.93 Favored 'General case' 0 N--CA 1.506 2.355 0 N-CA-C 116.332 1.975 . . . . 0.0 116.332 174.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.17 16.74 0.54 Allowed 'General case' 0 CA--C 1.575 1.919 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 174.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 67.7 mt-30 -104.29 -39.66 6.4 Favored 'General case' 0 CA--C 1.572 1.813 0 C-N-CA 125.005 1.322 . . . . 0.0 113.177 173.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.0 m -80.7 149.04 29.9 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 115.54 1.682 . . . . 0.0 115.54 -177.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -57.02 -54.55 45.44 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.114 0.966 . . . . 0.0 110.544 172.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 91.9 p -82.42 101.28 10.54 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 103.766 -2.679 . . . . 0.0 103.766 168.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -69.39 80.47 0.38 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 125.267 2.46 . . . . 0.0 113.89 -172.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.2 t -156.93 82.41 0.94 Allowed 'General case' 0 CA--C 1.56 1.354 0 CA-C-N 112.096 -2.32 . . . . 0.0 110.729 -173.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 29.7 t -81.5 109.08 15.63 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 105.418 -2.068 . . . . 0.0 105.418 172.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.58 123.29 34.11 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-O 122.453 1.12 . . . . 0.0 112.726 -172.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.499 ' HB2' HG12 ' A' ' 57' ' ' VAL . 17.0 t60 -82.02 149.04 28.31 Favored 'General case' 0 CA--C 1.559 1.296 0 CA-C-O 122.707 1.241 . . . . 0.0 113.732 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -65.92 -1.26 2.84 Favored 'General case' 0 CA--C 1.585 2.317 0 N-CA-C 116.279 1.955 . . . . 0.0 116.279 171.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.266 64.9 p 68.84 85.75 0.14 Allowed 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 127.192 2.197 . . . . 0.0 110.384 -178.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.276 5.3 mp 77.41 140.78 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.587 2.379 0 C-N-CA 125.426 1.49 . . . . 0.0 109.364 -173.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.309 10.0 tp 84.94 -138.24 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.103 0 C-N-CA 126.455 1.902 . . . . 0.0 109.19 -174.423 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 96.4 p -165.3 96.61 0.69 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 121.445 1.929 . . . . 0.0 114.218 178.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 54.6 tp -150.35 89.25 1.56 Allowed 'General case' 0 CA--C 1.564 1.503 0 N-CA-C 103.925 -2.62 . . . . 0.0 103.925 173.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.8 m -104.51 132.85 50.28 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 122.832 1.301 . . . . 0.0 113.394 -172.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -136.93 133.56 35.82 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.528 1.131 . . . . 0.0 108.822 -177.545 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 55.2 m -66.57 146.46 54.48 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 124.341 2.019 . . . . 0.0 113.703 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -138.25 -178.08 5.12 Favored 'General case' 0 CA--C 1.564 1.483 0 CA-C-N 112.615 -2.084 . . . . 0.0 112.338 -174.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.5 tp -83.83 125.09 31.62 Favored 'General case' 0 CA--C 1.569 1.706 0 O-C-N 121.313 -0.867 . . . . 0.0 111.05 174.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -61.02 148.5 39.98 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 123.891 0.876 . . . . 0.0 112.508 174.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.21 152.53 42.17 Favored 'General case' 0 CA--C 1.564 1.517 0 N-CA-C 118.529 2.788 . . . . 0.0 118.529 -170.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.63 168.09 9.31 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 112.82 -1.991 . . . . 0.0 111.45 -174.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -51.59 139.42 20.57 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -178.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.354 10.9 p30 57.75 28.9 16.57 Favored 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -172.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.9 m -129.43 153.1 48.27 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-O 122.691 1.234 . . . . 0.0 110.55 174.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -69.5 137.27 52.4 Favored 'General case' 0 CA--C 1.578 2.044 0 CA-C-O 124.631 2.158 . . . . 0.0 115.354 -175.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 27.3 p -142.0 147.59 37.16 Favored 'General case' 0 CA--C 1.566 1.592 0 CA-C-N 112.241 -2.254 . . . . 0.0 110.691 -178.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 60.2 m -77.62 104.48 8.18 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 119.707 -1.871 . . . . 0.0 108.025 174.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.465 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . . . -78.85 43.93 0.52 Allowed 'General case' 0 CA--C 1.573 1.855 0 N-CA-C 118.732 2.864 . . . . 0.0 118.732 -173.607 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.9 p90 -164.29 138.01 5.3 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 126.096 1.758 . . . . 0.0 107.834 -174.574 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.5 p -114.21 137.68 51.46 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-O 122.883 1.325 . . . . 0.0 109.96 174.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.275 2.1 pp -96.22 -78.74 0.46 Allowed 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 113.821 -1.536 . . . . 0.0 108.48 176.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -159.84 -14.67 0.06 Allowed 'General case' 0 CA--C 1.587 2.378 0 C-N-CA 125.584 1.554 . . . . 0.0 112.757 176.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -164.59 -93.05 0.09 OUTLIER Glycine 0 N--CA 1.478 1.496 0 O-C-N 120.127 -1.608 . . . . 0.0 115.87 -174.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.499 HG12 ' HB2' ' A' ' 30' ' ' HIS . 1.9 t -79.28 143.94 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.191 0 CA-C-N 119.18 1.49 . . . . 0.0 112.243 -164.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -126.86 144.05 51.09 Favored 'General case' 0 CA--C 1.56 1.346 0 N-CA-C 114.96 1.466 . . . . 0.0 114.96 -172.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -69.65 -44.65 70.14 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.832 173.002 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -139.13 115.86 10.74 Favored 'General case' 0 CA--C 1.565 1.553 0 N-CA-C 102.783 -3.043 . . . . 0.0 102.783 173.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 58.2 m -53.5 145.71 27.16 Favored Pre-proline 0 CA--C 1.591 2.548 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 -174.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -79.0 65.57 8.85 Favored 'Trans proline' 0 CA--C 1.571 2.372 0 C-N-CA 123.498 2.799 . . . . 0.0 117.42 -173.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 58.1 m 58.97 165.17 0.05 OUTLIER 'General case' 0 CA--C 1.579 2.086 0 N-CA-C 117.048 2.24 . . . . 0.0 117.048 176.221 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -72.61 149.71 43.7 Favored 'General case' 0 CA--C 1.567 1.627 0 O-C-N 120.818 -1.176 . . . . 0.0 112.978 174.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.73 103.98 0.98 Allowed 'General case' 0 N--CA 1.499 2.003 0 CA-C-O 122.83 1.3 . . . . 0.0 112.368 -174.404 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 131.09 -32.01 3.07 Favored Glycine 0 CA--C 1.558 2.774 0 CA-C-N 114.344 -1.298 . . . . 0.0 114.58 -171.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mp -96.77 151.5 19.58 Favored 'General case' 0 CA--C 1.566 1.59 0 CA-C-O 122.77 1.271 . . . . 0.0 111.456 172.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -99.36 154.53 18.12 Favored 'General case' 0 CA--C 1.562 1.404 0 CA-C-O 122.291 1.043 . . . . 0.0 112.142 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.465 ' SG ' ' HB2' ' A' ' 51' ' ' ALA . 17.2 t -93.71 118.43 31.4 Favored 'General case' 0 CA--C 1.569 1.68 0 CA-C-N 115.327 -0.851 . . . . 0.0 108.79 172.229 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 . . . . . 0 CA--C 1.57 1.732 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -172.667 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 99.5 m-85 . . . . . 0 CA--C 1.573 1.861 0 CA-C-O 121.959 0.885 . . . . 0.0 111.816 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -55.96 154.11 14.81 Favored Glycine 0 N--CA 1.499 2.87 0 N-CA-C 117.712 1.845 . . . . 0.0 117.712 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 42.6 mm -99.8 137.13 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 O-C-N 120.668 -1.489 . . . . 0.0 110.804 -172.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 67.3 m -68.72 124.25 23.14 Favored 'General case' 0 CA--C 1.572 1.814 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 174.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 69.9 m-70 -141.47 163.11 33.82 Favored 'General case' 0 CA--C 1.565 1.539 0 O-C-N 120.628 -1.295 . . . . 0.0 111.048 178.007 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -95.82 85.45 4.11 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 123.483 1.611 . . . . 0.0 111.981 -175.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 48.0 t . . . . . 0 N--CA 1.497 1.903 0 CA-C-N 113.535 -1.666 . . . . 0.0 106.862 177.046 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.304 1.0 OUTLIER . . . . . 0 N--CA 1.507 2.39 0 N-CA-C 118.918 2.933 . . . . 0.0 118.918 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.1 mp -99.01 123.07 43.05 Favored 'General case' 0 CA--C 1.567 1.625 0 CA-C-O 122.778 1.275 . . . . 0.0 112.052 175.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -84.78 169.92 13.73 Favored 'General case' 0 CA--C 1.574 1.892 0 O-C-N 121.129 -0.982 . . . . 0.0 111.087 172.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.77 123.58 17.44 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.621 -1.3 . . . . 0.0 111.471 175.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 111.12 -6.2 28.83 Favored Glycine 0 CA--C 1.559 2.804 0 N-CA-C 117.157 1.623 . . . . 0.0 117.157 -172.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -99.09 135.73 40.08 Favored 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 119.635 1.718 . . . . 0.0 111.857 -178.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.6 tt -76.04 128.04 34.2 Favored 'General case' 0 CA--C 1.575 1.924 0 O-C-N 121.46 -0.775 . . . . 0.0 112.183 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.6 p -120.7 -171.78 2.25 Favored 'General case' 0 CA--C 1.577 1.998 0 CA-C-O 123.206 1.479 . . . . 0.0 114.702 -174.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.6 mt -112.29 -75.92 0.6 Allowed 'General case' 0 CA--C 1.578 2.025 0 N-CA-C 103.815 -2.661 . . . . 0.0 103.815 169.143 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.1 p30 -93.91 -177.67 4.41 Favored 'General case' 0 CA--C 1.589 2.47 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 172.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.0 m -84.95 -17.66 36.99 Favored 'General case' 0 N--CA 1.508 2.428 0 N-CA-C 116.289 1.959 . . . . 0.0 116.289 173.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.25 7.4 2.82 Favored 'General case' 0 CA--C 1.583 2.241 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 173.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -94.4 -40.78 9.75 Favored 'General case' 0 CA--C 1.568 1.66 0 C-N-CA 126.17 1.788 . . . . 0.0 110.862 173.281 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.7 m -76.24 117.18 17.66 Favored 'General case' 0 CA--C 1.566 1.586 0 CA-C-N 119.449 1.022 . . . . 0.0 109.604 173.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -77.63 9.56 3.3 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 118.007 2.595 . . . . 0.0 118.007 -174.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 65.0 p -81.15 -88.32 0.08 Allowed 'General case' 0 CA--C 1.581 2.152 0 N-CA-C 104.346 -2.464 . . . . 0.0 104.346 169.299 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -171.41 25.71 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.167 0 C-N-CA 125.996 1.718 . . . . 0.0 111.056 171.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 5.9 t -161.51 120.57 2.46 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 119.003 2.964 . . . . 0.0 119.003 -170.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 35.4 t -103.4 119.99 39.94 Favored 'General case' 0 CA--C 1.56 1.352 0 N-CA-C 102.651 -3.092 . . . . 0.0 102.651 167.672 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -93.31 115.37 27.95 Favored 'General case' 0 CA--C 1.562 1.425 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 -172.191 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.639 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.9 t-160 -84.04 114.6 21.85 Favored 'General case' 0 CA--C 1.567 1.596 0 C-N-CA 124.55 1.14 . . . . 0.0 112.228 -178.53 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -82.78 89.75 6.82 Favored 'General case' 0 CA--C 1.571 1.768 0 O-C-N 119.927 -1.733 . . . . 0.0 111.439 174.08 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.305 5.6 t 52.6 -177.0 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -176.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 28.5 mm -57.65 -28.78 32.91 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.607 0 O-C-N 118.937 -2.352 . . . . 0.0 114.812 -179.36 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.6 mt -51.98 -21.91 3.5 Favored 'General case' 0 N--CA 1.503 2.177 0 N-CA-C 118.544 2.794 . . . . 0.0 118.544 174.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.406 39.2 p 100.19 -122.65 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 127.67 2.388 . . . . 0.0 112.187 174.578 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 31.0 tp 45.48 76.84 0.09 Allowed 'General case' 0 N--CA 1.504 2.233 0 CA-C-N 120.426 1.466 . . . . 0.0 112.978 -173.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 48.6 m -98.14 108.23 20.89 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-O 122.023 0.916 . . . . 0.0 112.51 -172.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 34.2 ttm105 -118.17 136.55 53.56 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 124.091 0.956 . . . . 0.0 110.331 -176.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 62.6 m -62.92 154.21 31.01 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 117.59 2.441 . . . . 0.0 117.59 -174.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.95 -175.8 4.36 Favored 'General case' 0 CA--C 1.572 1.791 0 CA-C-N 112.713 -2.04 . . . . 0.0 112.443 -177.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.8 tp -116.88 171.88 7.61 Favored 'General case' 0 CA--C 1.572 1.821 0 O-C-N 121.204 -0.935 . . . . 0.0 110.929 176.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -56.32 145.35 27.27 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.814 -1.179 . . . . 0.0 113.706 174.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.1 149.62 35.7 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-O 123.928 1.823 . . . . 0.0 115.267 -174.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 44.4 mtp180 -107.68 169.19 8.74 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-N 112.715 -2.039 . . . . 0.0 111.731 -178.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -51.18 125.52 14.19 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -174.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 77.84 7.76 2.6 Favored 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -173.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.0 t -102.46 157.25 17.05 Favored 'General case' 0 CA--C 1.564 1.498 0 CA-C-O 123.104 1.431 . . . . 0.0 112.472 174.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -76.96 107.11 9.07 Favored 'General case' 0 CA--C 1.567 1.629 0 CA-C-O 123.218 1.485 . . . . 0.0 114.477 -173.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 23.1 p -114.96 147.61 39.81 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 113.373 -1.739 . . . . 0.0 113.237 176.175 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.0 t -104.8 130.82 52.83 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 170.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.85 -39.11 66.79 Favored 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 176.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -95.01 160.13 14.71 Favored 'General case' 0 CA--C 1.574 1.871 0 C-N-CA 125.541 1.536 . . . . 0.0 110.18 172.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 35.7 p -128.98 152.32 48.72 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-O 123.592 1.663 . . . . 0.0 110.434 173.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -97.38 -59.35 1.8 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 114.133 -1.394 . . . . 0.0 112.187 175.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -164.68 -52.31 0.03 OUTLIER 'General case' 0 CA--C 1.572 1.804 0 C-N-CA 126.195 1.798 . . . . 0.0 109.476 -176.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 100.69 102.4 2.52 Favored Glycine 0 CA--C 1.542 1.756 0 CA-C-O 122.754 1.197 . . . . 0.0 114.749 -177.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.639 HG12 ' HB2' ' A' ' 30' ' ' HIS . 13.8 t -103.58 141.33 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.123 0 O-C-N 118.09 -3.006 . . . . 0.0 107.704 83.784 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -113.4 133.91 54.92 Favored 'General case' 0 CA--C 1.553 1.058 0 N-CA-C 116.691 2.108 . . . . 0.0 116.691 -171.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -85.3 6.1 27.71 Favored 'General case' 0 CA--C 1.595 2.694 0 CA-C-N 115.04 -0.982 . . . . 0.0 113.482 169.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.85 102.95 0.79 Allowed 'General case' 0 CA--C 1.57 1.745 0 C-N-CA 127.563 2.345 . . . . 0.0 107.104 -171.391 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 95.6 m -67.56 131.95 92.92 Favored Pre-proline 0 CA--C 1.581 2.161 0 O-C-N 118.827 -2.42 . . . . 0.0 113.216 175.105 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -48.95 152.1 4.99 Favored 'Trans proline' 0 CA--C 1.569 2.227 0 C-N-CA 122.949 2.433 . . . . 0.0 116.68 175.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 1.8 t -74.25 150.68 40.14 Favored 'General case' 0 CA--C 1.572 1.826 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -173.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -67.76 162.38 24.0 Favored 'General case' 0 CA--C 1.574 1.886 0 N-CA-C 115.872 1.804 . . . . 0.0 115.872 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -64.25 119.05 9.54 Favored 'General case' 0 CA--C 1.572 1.808 0 O-C-N 120.735 -1.228 . . . . 0.0 111.754 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.91 -32.2 6.72 Favored Glycine 0 N--CA 1.494 2.56 0 CA-C-N 114.687 -1.142 . . . . 0.0 115.738 -172.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.6 mp -99.4 143.19 29.94 Favored 'General case' 0 CA--C 1.563 1.473 0 CA-C-O 122.798 1.285 . . . . 0.0 111.251 176.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.7 150.13 21.53 Favored 'General case' 0 CA--C 1.561 1.37 0 CA-C-O 122.449 1.118 . . . . 0.0 111.428 179.033 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 7.7 t -97.06 114.84 26.52 Favored 'General case' 0 CA--C 1.567 1.606 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.579 173.393 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 . . . . . 0 N--CA 1.498 1.942 0 O-C-N 120.476 -1.39 . . . . 0.0 109.835 177.218 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 . . . . . 0 CA--C 1.572 1.812 0 CA-C-O 121.772 0.796 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -141.84 -174.79 14.8 Favored Glycine 0 N--CA 1.493 2.466 0 O-C-N 119.778 -1.826 . . . . 0.0 116.822 176.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.6 mm -126.49 142.95 41.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 CA-C-O 122.101 0.953 . . . . 0.0 110.081 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 8.0 m -73.83 127.77 33.73 Favored 'General case' 0 CA--C 1.569 1.71 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 173.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 72.3 m-70 -140.52 155.86 46.5 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.824 -1.172 . . . . 0.0 109.623 174.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -92.41 81.14 4.89 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 119.528 -1.982 . . . . 0.0 113.064 -173.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 72.5 t . . . . . 0 N--CA 1.502 2.163 0 CA-C-N 112.685 -2.052 . . . . 0.0 112.865 -179.411 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 . . . . . 0 N--CA 1.507 2.387 0 N-CA-C 116.135 1.902 . . . . 0.0 116.135 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 36.7 tp -115.15 123.5 49.09 Favored 'General case' 0 CA--C 1.576 1.964 0 O-C-N 120.578 -1.327 . . . . 0.0 111.649 -177.072 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -66.1 162.81 18.83 Favored 'General case' 0 CA--C 1.576 1.976 0 O-C-N 119.757 -1.84 . . . . 0.0 115.624 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.31 130.38 44.24 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-O 121.928 0.87 . . . . 0.0 111.123 174.602 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 116.74 -13.8 14.8 Favored Glycine 0 CA--C 1.557 2.711 0 N-CA-C 116.844 1.498 . . . . 0.0 116.844 -172.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -103.98 151.15 23.54 Favored 'General case' 0 CA--C 1.567 1.627 0 CA-C-N 119.123 1.461 . . . . 0.0 112.716 -176.295 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.0 tt -73.33 123.43 23.76 Favored 'General case' 0 CA--C 1.574 1.888 0 O-C-N 121.308 -0.87 . . . . 0.0 112.095 -178.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.4 p -123.57 155.13 38.22 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 -176.213 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 mp -89.22 -76.67 0.4 Allowed 'General case' 0 CA--C 1.568 1.666 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 174.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -95.68 170.06 9.59 Favored 'General case' 0 CA--C 1.576 1.965 0 N-CA-C 114.414 1.264 . . . . 0.0 114.414 173.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 66.8 m -76.87 -21.58 54.74 Favored 'General case' 0 N--CA 1.507 2.381 0 N-CA-C 117.244 2.313 . . . . 0.0 117.244 176.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.79 7.26 3.23 Favored 'General case' 0 CA--C 1.583 2.229 0 N-CA-C 116.813 2.153 . . . . 0.0 116.813 174.234 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -96.2 -24.88 16.04 Favored 'General case' 0 CA--C 1.57 1.716 0 N-CA-C 115.662 1.727 . . . . 0.0 115.662 176.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 18.6 m -78.27 171.69 14.69 Favored 'General case' 0 CA--C 1.58 2.131 0 CA-C-N 121.029 1.74 . . . . 0.0 114.161 177.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -68.41 -65.37 0.71 Allowed 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.516 -1.365 . . . . 0.0 108.234 172.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 57.7 m -83.28 109.36 17.19 Favored 'General case' 0 CA--C 1.565 1.537 0 N-CA-C 101.157 -3.645 . . . . 0.0 101.157 168.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -67.66 82.36 0.18 Allowed 'General case' 0 N--CA 1.503 2.201 0 CA-C-O 125.158 2.409 . . . . 0.0 114.833 -171.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.8 t -145.25 77.39 1.52 Allowed 'General case' 0 CA--C 1.562 1.415 0 CA-C-N 111.549 -2.569 . . . . 0.0 112.482 -172.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.9 t -79.38 117.41 20.34 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 103.862 -2.644 . . . . 0.0 103.862 171.222 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.39 111.18 23.49 Favored 'General case' 0 CA--C 1.566 1.588 0 CA-C-O 123.256 1.503 . . . . 0.0 114.726 -169.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.517 ' HB2' HG12 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -85.56 172.1 11.21 Favored 'General case' 0 CA--C 1.572 1.803 0 C-N-CA 126.514 1.926 . . . . 0.0 111.82 174.744 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -76.1 -62.91 1.44 Allowed 'General case' 0 CA--C 1.588 2.407 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 169.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.6 p -147.26 -92.45 0.09 Allowed 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 102.329 -3.211 . . . . 0.0 102.329 172.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 92.3 mt -119.07 -12.13 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.567 0 CA-C-N 121.661 2.028 . . . . 0.0 113.318 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.9 tp -127.3 94.71 4.07 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 122.652 2.478 . . . . 0.0 112.214 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.7 p -172.43 164.7 5.71 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 124.473 1.109 . . . . 0.0 112.949 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 15.6 tp -75.56 121.45 22.42 Favored 'General case' 0 CA--C 1.574 1.892 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 171.59 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.4 m -95.69 138.89 32.71 Favored 'General case' 0 CA--C 1.569 1.693 0 O-C-N 121.246 -0.909 . . . . 0.0 113.304 -172.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 18.5 ttp180 -132.64 144.07 50.09 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.377 -0.827 . . . . 0.0 111.831 -175.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 71.6 m -63.76 138.4 58.47 Favored 'General case' 0 CA--C 1.566 1.574 0 O-C-N 119.676 -1.89 . . . . 0.0 113.302 175.501 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -138.88 -172.14 3.25 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-N 113.937 -1.483 . . . . 0.0 113.243 -173.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.5 mt -89.2 151.14 22.33 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-O 122.261 1.029 . . . . 0.0 112.74 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.15 152.66 36.64 Favored 'General case' 0 CA--C 1.572 1.825 0 O-C-N 121.619 -0.676 . . . . 0.0 112.525 173.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.476 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . . . -79.93 171.14 15.51 Favored 'General case' 0 CA--C 1.573 1.833 0 CA-C-O 123.435 1.588 . . . . 0.0 114.186 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -118.83 164.97 14.62 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 122.897 1.332 . . . . 0.0 112.304 -174.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -61.24 137.77 58.23 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.299 -0.875 . . . . 0.0 113.209 178.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 64.58 26.37 13.27 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -173.096 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 52.4 m -123.01 149.62 44.09 Favored 'General case' 0 CA--C 1.561 1.378 0 CA-C-O 122.929 1.347 . . . . 0.0 110.186 174.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -75.63 102.13 5.22 Favored 'General case' 0 CA--C 1.576 1.945 0 CA-C-O 124.213 1.959 . . . . 0.0 114.131 -176.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.446 ' SG ' ' HA ' ' A' ' 62' ' ' PRO . 4.4 t -95.29 149.61 21.16 Favored 'General case' 0 CA--C 1.565 1.543 0 CA-C-O 124.066 1.889 . . . . 0.0 111.122 173.746 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.7 p -93.33 113.01 25.09 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 114.405 -1.27 . . . . 0.0 108.307 174.04 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.4 -8.32 59.02 Favored 'General case' 0 CA--C 1.563 1.462 0 N-CA-C 117.426 2.38 . . . . 0.0 117.426 -175.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . 0.334 0.2 OUTLIER -94.65 176.12 6.4 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 117.383 2.364 . . . . 0.0 117.383 -174.513 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.4 m 79.04 -147.08 0.02 OUTLIER 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 100.793 -3.78 . . . . 0.0 100.793 -167.074 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 54' ' ' LEU 0.596 2.8 mm? -177.98 -77.0 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.025 0 O-C-N 116.991 -3.568 . . . . 0.0 110.583 162.243 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -77.87 -20.31 53.25 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.91 -1.119 . . . . 0.0 112.607 171.058 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -90.0 -152.42 26.87 Favored Glycine 0 CA--C 1.55 2.242 0 CA-C-O 123.338 1.521 . . . . 0.0 112.507 172.663 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.517 HG12 ' HB2' ' A' ' 30' ' ' HIS . 10.0 t -84.62 139.41 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 CA-C-O 123.026 1.394 . . . . 0.0 114.038 -165.42 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -105.65 156.16 18.54 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -174.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -90.91 -68.07 0.81 Allowed 'General case' 0 N--CA 1.503 2.215 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 -175.042 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -116.91 96.03 5.28 Favored 'General case' 0 CA--C 1.567 1.616 0 N-CA-C 101.747 -3.427 . . . . 0.0 101.747 170.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 66.9 m -39.03 149.86 0.23 Allowed Pre-proline 0 CA--C 1.578 2.03 0 N-CA-C 120.547 3.536 . . . . 0.0 120.547 -173.117 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.446 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 78.8 Cg_endo -65.63 170.9 10.41 Favored 'Trans proline' 0 CA--C 1.568 2.197 0 C-N-CA 122.223 1.949 . . . . 0.0 114.552 174.874 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.476 ' SG ' ' HB3' ' A' ' 43' ' ' ALA . 95.3 m -88.76 178.37 6.48 Favored 'General case' 0 CA--C 1.571 1.758 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 -174.674 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -61.55 174.53 0.75 Allowed 'General case' 0 CA--C 1.579 2.092 0 N-CA-C 117.494 2.405 . . . . 0.0 117.494 -174.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 24.6 tpt180 -61.02 111.63 1.76 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.124 -1.61 . . . . 0.0 113.136 -175.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 96.79 -19.74 53.49 Favored Glycine 0 N--CA 1.499 2.88 0 N-CA-C 116.892 1.517 . . . . 0.0 116.892 -172.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.94 120.35 38.17 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 124.804 1.242 . . . . 0.0 108.603 176.511 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.81 164.31 12.62 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 115.532 1.679 . . . . 0.0 115.532 -172.567 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 14.4 t -91.8 104.41 16.86 Favored 'General case' 0 CA--C 1.566 1.559 0 CA-C-N 113.306 -1.77 . . . . 0.0 107.32 171.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 . . . . . 0 N--CA 1.494 1.746 0 CA-C-N 121.525 1.966 . . . . 0.0 107.533 -177.792 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 . . . . . 0 CA--C 1.574 1.876 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -126.92 171.7 18.53 Favored Glycine 0 N--CA 1.494 2.507 0 O-C-N 120.915 -1.116 . . . . 0.0 114.397 175.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.6 mm -96.96 139.99 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.246 0 O-C-N 119.883 -1.951 . . . . 0.0 112.118 -168.183 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 3.8 m -74.3 131.92 41.61 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.249 -1.532 . . . . 0.0 114.39 173.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 64.7 m-70 -140.59 158.62 43.72 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 122.531 1.158 . . . . 0.0 110.98 177.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -95.94 130.21 42.98 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 120.964 -1.085 . . . . 0.0 111.623 -176.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.6 p . . . . . 0 N--CA 1.497 1.886 0 N-CA-C 114.719 1.377 . . . . 0.0 114.719 -173.407 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 . . . . . 0 N--CA 1.508 2.434 0 CA-C-O 121.416 0.627 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.73 139.9 51.99 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 123.363 1.554 . . . . 0.0 114.61 -176.385 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.5 156.88 30.71 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 122.241 1.02 . . . . 0.0 113.138 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -80.9 119.7 23.78 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 122.716 1.246 . . . . 0.0 109.02 -175.593 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 129.64 -20.61 5.16 Favored Glycine 0 CA--C 1.558 2.769 0 CA-C-N 114.222 -1.354 . . . . 0.0 114.692 -171.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.284 6.0 tp10 -99.62 158.85 15.47 Favored 'General case' 0 CA--C 1.572 1.802 0 CA-C-N 119.436 1.618 . . . . 0.0 112.036 -178.631 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.8 tp -75.37 135.44 40.81 Favored 'General case' 0 CA--C 1.578 2.028 0 O-C-N 120.963 -1.085 . . . . 0.0 113.714 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.9 p -133.85 159.74 39.75 Favored 'General case' 0 CA--C 1.564 1.514 0 C-N-CA 124.871 1.268 . . . . 0.0 112.361 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.7 mt -92.48 -77.14 0.44 Allowed 'General case' 0 CA--C 1.566 1.59 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 173.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.3 p30 -91.24 167.38 12.36 Favored 'General case' 0 CA--C 1.58 2.117 0 N-CA-C 115.43 1.641 . . . . 0.0 115.43 174.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.2 m -70.51 -20.79 62.81 Favored 'General case' 0 N--CA 1.509 2.52 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 174.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.96 4.45 5.37 Favored 'General case' 0 CA--C 1.579 2.088 0 N-CA-C 116.909 2.188 . . . . 0.0 116.909 174.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -94.83 -31.48 13.7 Favored 'General case' 0 CA--C 1.565 1.522 0 C-N-CA 125.082 1.353 . . . . 0.0 114.371 174.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 11.2 m -78.17 157.59 29.34 Favored 'General case' 0 CA--C 1.574 1.881 0 CA-C-N 121.703 2.047 . . . . 0.0 114.18 177.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -61.97 -57.07 13.1 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.753 -1.217 . . . . 0.0 109.506 172.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.7 m -83.82 110.6 18.48 Favored 'General case' 0 CA--C 1.567 1.597 0 N-CA-C 102.737 -3.06 . . . . 0.0 102.737 169.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -66.27 82.47 0.09 Allowed 'General case' 0 N--CA 1.502 2.141 0 CA-C-O 124.187 1.946 . . . . 0.0 114.153 -172.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.6 t -154.03 82.75 1.14 Allowed 'General case' 0 CA--C 1.567 1.611 0 CA-C-N 112.843 -1.98 . . . . 0.0 112.956 -173.029 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.9 t -85.6 111.86 20.44 Favored 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 104.231 -2.507 . . . . 0.0 104.231 171.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.15 123.06 43.16 Favored 'General case' 0 CA--C 1.561 1.388 0 CA-C-O 122.443 1.116 . . . . 0.0 112.841 -171.355 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -79.82 129.5 34.53 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.111 0.964 . . . . 0.0 112.404 -173.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -76.41 43.57 0.31 Allowed 'General case' 0 CA--C 1.583 2.218 0 N-CA-C 116.414 2.005 . . . . 0.0 116.414 174.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 43.7 p 61.03 88.28 0.09 Allowed 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 125.769 1.628 . . . . 0.0 114.306 174.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 23.6 mm 75.11 -57.19 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.613 0 C-N-CA 125.138 1.375 . . . . 0.0 113.264 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -42.67 -44.98 4.52 Favored 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 118.361 2.726 . . . . 0.0 118.361 -177.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.338 28.6 p 96.47 -4.91 0.07 Allowed 'General case' 0 N--CA 1.507 2.408 0 N-CA-C 118.81 2.893 . . . . 0.0 118.81 173.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 mp -74.61 95.35 2.8 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 121.926 2.148 . . . . 0.0 106.609 172.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.8 m -97.64 134.07 41.33 Favored 'General case' 0 CA--C 1.559 1.317 0 CA-C-N 114.661 -1.154 . . . . 0.0 113.67 -170.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 68.3 ttp85 -114.24 144.57 43.0 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.224 1.01 . . . . 0.0 111.687 -176.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 75.1 m -69.4 132.5 46.46 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 119.92 -1.737 . . . . 0.0 111.096 173.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.27 178.92 7.08 Favored 'General case' 0 CA--C 1.568 1.643 0 N-CA-C 115.151 1.537 . . . . 0.0 115.151 -173.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.571 HD13 ' H ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -86.82 160.29 18.81 Favored 'General case' 0 CA--C 1.573 1.842 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 178.054 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.59 156.63 25.08 Favored 'General case' 0 CA--C 1.582 2.173 0 CA-C-O 121.923 0.868 . . . . 0.0 112.533 175.238 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.01 166.21 21.79 Favored 'General case' 0 CA--C 1.572 1.819 0 N-CA-C 116.588 2.07 . . . . 0.0 116.588 -175.244 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 13.4 mtp-105 -131.33 171.39 13.41 Favored 'General case' 0 CA--C 1.564 1.519 0 CA-C-N 113.961 -1.472 . . . . 0.0 111.555 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -45.98 129.79 9.71 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 116.682 2.105 . . . . 0.0 116.682 -174.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 73.04 10.1 5.31 Favored 'General case' 0 N--CA 1.505 2.298 0 N-CA-C 115.623 1.712 . . . . 0.0 115.623 -174.298 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.0 t -107.92 159.49 16.49 Favored 'General case' 0 CA--C 1.567 1.607 0 CA-C-O 122.969 1.366 . . . . 0.0 111.286 174.038 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -71.39 128.4 35.73 Favored 'General case' 0 CA--C 1.563 1.466 0 CA-C-O 123.164 1.459 . . . . 0.0 114.006 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -122.37 128.53 51.09 Favored 'General case' 0 CA--C 1.561 1.387 0 CA-C-N 113.304 -1.771 . . . . 0.0 108.974 173.627 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.3 t -86.7 97.49 10.61 Favored 'General case' 0 CA--C 1.558 1.253 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.555 173.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.413 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . . . -78.52 76.63 5.02 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 123.616 1.674 . . . . 0.0 112.159 -176.702 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -144.67 153.74 42.06 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 117.419 2.378 . . . . 0.0 117.419 -171.443 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.1 p -149.25 135.96 19.54 Favored 'General case' 0 CA--C 1.558 1.267 0 CA-C-O 124.265 1.983 . . . . 0.0 106.3 169.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.287 1.9 pp -141.35 -80.11 0.25 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 112.982 -1.917 . . . . 0.0 105.917 -176.551 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -150.84 -1.42 0.37 Allowed 'General case' 0 CA--C 1.591 2.522 0 C-N-CA 126.409 1.883 . . . . 0.0 110.759 172.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 170.97 -83.71 0.08 OUTLIER Glycine 0 C--N 1.351 1.391 0 O-C-N 119.046 -2.284 . . . . 0.0 117.686 -173.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 2.4 t -78.39 137.05 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 CA-C-N 119.758 1.779 . . . . 0.0 113.035 -157.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -123.96 130.5 52.69 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.109 -1.405 . . . . 0.0 110.458 -173.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -62.54 -43.73 98.09 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -178.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.6 mptt -139.33 106.87 5.57 Favored 'General case' 0 CA--C 1.562 1.434 0 N-CA-C 103.519 -2.771 . . . . 0.0 103.519 173.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.0 m -49.65 147.78 5.82 Favored Pre-proline 0 CA--C 1.591 2.525 0 N-CA-C 117.058 2.244 . . . . 0.0 117.058 -174.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -60.75 172.35 2.92 Favored 'Trans proline' 0 CA--C 1.569 2.231 0 C-N-CA 122.877 2.385 . . . . 0.0 118.003 -173.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 35.3 m -73.0 161.69 30.39 Favored 'General case' 0 CA--C 1.573 1.833 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -174.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -62.53 156.73 22.2 Favored 'General case' 0 CA--C 1.577 2.007 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -61.73 109.45 1.22 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.745 -1.222 . . . . 0.0 113.495 -174.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.86 -24.82 18.35 Favored Glycine 0 N--CA 1.5 2.923 0 N-CA-C 116.502 1.361 . . . . 0.0 116.502 -172.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 tt -98.28 136.7 38.09 Favored 'General case' 0 CA--C 1.574 1.877 0 C-N-CA 124.897 1.279 . . . . 0.0 109.034 176.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.89 159.01 15.2 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 116.855 2.169 . . . . 0.0 116.855 -172.161 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.413 ' SG ' ' HB2' ' A' ' 51' ' ' ALA . 9.1 t -95.55 132.43 40.68 Favored 'General case' 0 CA--C 1.573 1.849 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.329 171.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.298 2.8 pp20? . . . . . 0 N--CA 1.506 2.339 0 CA-C-N 122.096 2.226 . . . . 0.0 112.169 177.032 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 122.097 0.951 . . . . 0.0 112.822 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.42 162.17 41.12 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 118.608 2.203 . . . . 0.0 118.608 175.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 19.6 mm -98.43 148.3 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.003 0 CA-C-O 122.587 1.184 . . . . 0.0 109.459 176.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.8 m -72.66 125.3 27.15 Favored 'General case' 0 CA--C 1.571 1.765 0 O-C-N 120.397 -1.439 . . . . 0.0 113.153 173.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 70.7 m-70 -140.51 152.29 45.46 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 120.245 -1.534 . . . . 0.0 111.573 176.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -96.94 122.57 40.06 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-O 122.102 0.953 . . . . 0.0 109.674 177.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 46.0 t . . . . . 0 N--CA 1.503 2.184 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -174.553 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 . . . . . 0 CA--C 1.582 2.204 0 N-CA-C 116.374 1.99 . . . . 0.0 116.374 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -149.68 146.05 27.04 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 123.34 1.543 . . . . 0.0 113.249 173.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -84.82 171.64 12.09 Favored 'General case' 0 CA--C 1.569 1.709 0 N-CA-C 114.071 1.138 . . . . 0.0 114.071 -178.352 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.21 127.51 31.62 Favored 'General case' 0 CA--C 1.575 1.906 0 O-C-N 121.14 -0.975 . . . . 0.0 111.466 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 117.41 -20.74 11.06 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 117.061 1.584 . . . . 0.0 117.061 -173.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -101.87 153.44 19.84 Favored 'General case' 0 CA--C 1.575 1.912 0 CA-C-N 119.064 1.432 . . . . 0.0 112.319 -179.134 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 tt -74.55 129.66 38.16 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.075 -1.016 . . . . 0.0 113.464 -174.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.6 p -127.02 151.24 48.86 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 124.272 1.029 . . . . 0.0 112.955 178.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.8 mp -87.79 -71.78 0.56 Allowed 'General case' 0 CA--C 1.57 1.719 0 O-C-N 120.946 -1.096 . . . . 0.0 108.46 173.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -95.25 173.48 7.53 Favored 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 120.531 1.514 . . . . 0.0 114.563 173.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.3 m -77.98 -19.1 55.11 Favored 'General case' 0 N--CA 1.505 2.282 0 N-CA-C 117.204 2.298 . . . . 0.0 117.204 176.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.91 10.69 2.64 Favored 'General case' 0 CA--C 1.58 2.131 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 172.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -94.41 -46.66 6.92 Favored 'General case' 0 CA--C 1.558 1.287 0 CA-C-O 117.67 -1.157 . . . . 0.0 113.071 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.9 m -65.87 149.24 50.51 Favored 'General case' 0 CA--C 1.576 1.959 0 CA-C-N 122.076 2.216 . . . . 0.0 113.685 178.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.0 mmmp? -59.37 -53.61 56.17 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 120.621 -1.3 . . . . 0.0 110.536 172.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 87.6 p -82.96 100.0 10.15 Favored 'General case' 0 CA--C 1.572 1.817 0 N-CA-C 102.179 -3.267 . . . . 0.0 102.179 167.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 51.6 m-80 -67.64 85.46 0.19 Allowed 'General case' 0 N--CA 1.501 2.12 0 CA-C-O 125.238 2.447 . . . . 0.0 114.611 -170.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 t -152.31 77.77 1.2 Allowed 'General case' 0 CA--C 1.562 1.424 0 CA-C-N 111.216 -2.72 . . . . 0.0 110.725 -173.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.3 t -82.1 111.16 17.98 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 172.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.52 130.28 46.57 Favored 'General case' 0 CA--C 1.556 1.193 0 CA-C-O 122.145 0.974 . . . . 0.0 111.338 -172.642 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -79.42 173.34 12.68 Favored 'General case' 0 CA--C 1.568 1.638 0 N-CA-C 114.894 1.442 . . . . 0.0 114.894 -173.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 44.6 p-10 -80.46 -63.98 1.29 Allowed 'General case' 0 CA--C 1.568 1.673 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 173.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.5 m -160.8 -83.76 0.04 OUTLIER 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 104.479 -2.415 . . . . 0.0 104.479 171.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 69.4 mt -123.53 -22.45 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.302 0 CA-C-N 120.116 1.325 . . . . 0.0 112.805 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.9 tp -76.89 -113.94 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 122.467 2.394 . . . . 0.0 111.642 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 95.3 p -161.05 101.67 1.26 Allowed 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 122.733 2.515 . . . . 0.0 115.571 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.8 tp -163.79 86.36 0.49 Allowed 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 103.821 -2.659 . . . . 0.0 103.821 172.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 11.8 m -105.77 129.56 53.94 Favored 'General case' 0 CA--C 1.566 1.576 0 CA-C-O 122.532 1.158 . . . . 0.0 112.712 -172.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 19.2 ttp180 -132.49 146.59 52.05 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.368 1.067 . . . . 0.0 110.655 -175.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 73.2 m -67.98 142.32 56.0 Favored 'General case' 0 CA--C 1.563 1.475 0 O-C-N 119.821 -1.799 . . . . 0.0 113.598 176.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.83 -173.81 3.81 Favored 'General case' 0 CA--C 1.569 1.693 0 CA-C-N 114.202 -1.363 . . . . 0.0 113.664 -174.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.9 mt -92.29 154.37 18.64 Favored 'General case' 0 CA--C 1.57 1.736 0 CA-C-O 122.47 1.128 . . . . 0.0 112.732 176.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.85 150.63 34.16 Favored 'General case' 0 CA--C 1.575 1.909 0 C-N-CA 123.648 0.779 . . . . 0.0 112.387 173.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.67 158.63 29.62 Favored 'General case' 0 CA--C 1.568 1.653 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 -173.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -115.23 168.59 9.82 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 113.464 -1.698 . . . . 0.0 111.414 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -53.55 130.16 35.02 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -174.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 72.05 27.91 2.6 Favored 'General case' 0 N--CA 1.506 2.338 0 C-N-CA 124.875 1.27 . . . . 0.0 114.101 -173.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.8 m -125.08 150.03 47.23 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.658 -1.277 . . . . 0.0 110.345 174.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -71.68 131.19 42.81 Favored 'General case' 0 CA--C 1.57 1.74 0 CA-C-O 122.941 1.353 . . . . 0.0 112.452 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.416 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 25.0 p -134.14 160.74 36.89 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-N 113.74 -1.573 . . . . 0.0 114.995 -174.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.1 m -79.38 101.94 8.41 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.892 0.854 . . . . 0.0 109.672 176.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -76.86 -47.56 20.93 Favored 'General case' 0 CA--C 1.571 1.783 0 N-CA-C 115.751 1.76 . . . . 0.0 115.751 -174.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -102.7 104.84 15.2 Favored 'General case' 0 CA--C 1.568 1.635 0 C-N-CA 124.599 1.16 . . . . 0.0 108.057 174.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.3 p -98.55 134.29 41.72 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 123.559 1.647 . . . . 0.0 113.799 -174.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -98.58 -170.83 2.01 Favored 'General case' 0 CA--C 1.578 2.031 0 CA-C-N 112.462 -2.153 . . . . 0.0 108.939 172.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -99.58 62.23 1.2 Allowed 'General case' 0 N--CA 1.501 2.119 0 CA-C-O 123.518 1.628 . . . . 0.0 108.38 174.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -169.49 -168.79 31.95 Favored Glycine 0 N--CA 1.475 1.275 0 CA-C-O 123.593 1.663 . . . . 0.0 114.149 -173.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.1 t -78.78 147.68 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 CA-C-O 123.215 1.483 . . . . 0.0 112.619 -163.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -117.09 138.34 51.69 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-N 114.313 -1.312 . . . . 0.0 113.396 -173.049 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -68.36 -33.16 73.77 Favored 'General case' 0 CA--C 1.589 2.479 0 O-C-N 121.256 -0.902 . . . . 0.0 112.697 172.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.56 109.65 3.72 Favored 'General case' 0 CA--C 1.566 1.59 0 N-CA-C 105.324 -2.102 . . . . 0.0 105.324 177.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 59.2 m -52.17 157.05 2.42 Favored Pre-proline 0 CA--C 1.591 2.551 0 N-CA-C 118.78 2.881 . . . . 0.0 118.78 -174.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -54.14 167.18 1.29 Allowed 'Trans proline' 0 CA--C 1.566 2.094 0 C-N-CA 123.374 2.716 . . . . 0.0 118.032 176.31 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.416 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 69.3 m -71.43 162.2 29.83 Favored 'General case' 0 CA--C 1.574 1.884 0 N-CA-C 115.028 1.492 . . . . 0.0 115.028 177.429 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -62.62 161.18 12.61 Favored 'General case' 0 CA--C 1.576 1.966 0 N-CA-C 115.624 1.712 . . . . 0.0 115.624 177.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 72.3 ttt180 -62.0 116.88 5.28 Favored 'General case' 0 CA--C 1.572 1.792 0 O-C-N 120.697 -1.252 . . . . 0.0 112.888 -175.385 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.29 -21.44 41.33 Favored Glycine 0 CA--C 1.559 2.842 0 N-CA-C 117.101 1.6 . . . . 0.0 117.101 -172.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 tp -99.78 141.27 32.8 Favored 'General case' 0 CA--C 1.572 1.814 0 C-N-CA 124.803 1.241 . . . . 0.0 111.545 -179.173 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -99.11 151.27 21.16 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.409 -1.432 . . . . 0.0 113.945 -174.489 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 13.1 t -95.41 99.12 11.08 Favored 'General case' 0 CA--C 1.57 1.715 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.49 172.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 . . . . . 0 N--CA 1.497 1.912 0 O-C-N 120.483 -1.386 . . . . 0.0 110.38 -179.766 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.0 m-30 . . . . . 0 N--CA 1.495 1.823 0 N-CA-C 116.216 1.932 . . . . 0.0 116.216 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -146.17 174.55 26.04 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 115.902 1.121 . . . . 0.0 115.902 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.8 mm -111.39 143.27 21.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 CA-C-O 122.17 0.986 . . . . 0.0 109.865 -177.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.413 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 69.4 m -71.04 120.61 16.85 Favored 'General case' 0 CA--C 1.569 1.701 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 174.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 71.8 m-70 -142.02 161.07 38.91 Favored 'General case' 0 CA--C 1.565 1.55 0 CA-C-O 123.349 1.547 . . . . 0.0 111.751 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -97.66 102.36 14.1 Favored 'General case' 0 CA--C 1.563 1.466 0 O-C-N 120.932 -1.105 . . . . 0.0 110.732 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 41.4 t . . . . . 0 N--CA 1.498 1.963 0 CA-C-O 122.354 1.074 . . . . 0.0 108.635 -175.1 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 . . . . . 0 N--CA 1.501 2.123 0 CA-C-O 122.409 1.099 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.439 ' H ' ' HA ' ' A' ' 23' ' ' CYS . 0.7 OUTLIER -125.83 149.85 48.31 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 123.402 1.572 . . . . 0.0 113.799 -177.847 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -79.5 165.05 23.42 Favored 'General case' 0 CA--C 1.573 1.832 0 O-C-N 120.944 -1.097 . . . . 0.0 112.358 174.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.21 132.64 44.37 Favored 'General case' 0 CA--C 1.574 1.868 0 O-C-N 120.611 -1.306 . . . . 0.0 111.348 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 116.28 13.89 8.0 Favored Glycine 0 CA--C 1.558 2.776 0 N-CA-C 115.705 1.042 . . . . 0.0 115.705 -172.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -129.49 152.3 49.17 Favored 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 119.187 1.493 . . . . 0.0 110.433 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 54.3 mt -72.28 125.94 28.58 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.095 -1.003 . . . . 0.0 113.304 -177.029 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.8 p -121.29 143.51 49.13 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 124.164 0.985 . . . . 0.0 112.271 -177.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.5 mt -78.77 -72.13 0.4 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.035 -1.04 . . . . 0.0 109.279 174.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 60.7 m-20 -99.03 -165.59 1.25 Allowed 'General case' 0 CA--C 1.578 2.046 0 CA-C-N 119.229 0.922 . . . . 0.0 112.551 172.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.1 t -82.8 -24.68 33.29 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 119.784 -1.822 . . . . 0.0 114.964 172.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.24 62.66 6.06 Favored 'General case' 0 CA--C 1.574 1.867 0 CA-C-O 125.057 2.36 . . . . 0.0 111.672 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -137.68 -59.49 0.67 Allowed 'General case' 0 CA--C 1.566 1.558 0 CA-C-N 111.531 -2.577 . . . . 0.0 109.929 -174.244 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.439 ' HA ' ' H ' ' A' ' 11' ' ' LEU . 71.9 m -83.29 155.03 23.82 Favored 'General case' 0 CA--C 1.57 1.734 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 175.479 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.6 mtpt -60.75 -53.51 56.51 Favored 'General case' 0 N--CA 1.502 2.147 0 C-N-CA 124.089 0.956 . . . . 0.0 109.877 171.234 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 92.2 p -81.88 101.84 10.48 Favored 'General case' 0 CA--C 1.569 1.689 0 N-CA-C 105.353 -2.091 . . . . 0.0 105.353 170.06 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -72.7 76.72 1.11 Allowed 'General case' 0 N--CA 1.501 2.121 0 CA-C-O 124.973 2.32 . . . . 0.0 113.418 -173.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 t -139.94 70.54 1.36 Allowed 'General case' 0 CA--C 1.562 1.427 0 CA-C-N 111.99 -2.368 . . . . 0.0 108.28 -178.163 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.2 t -78.0 108.75 11.5 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 173.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.18 120.16 39.46 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-O 122.861 1.315 . . . . 0.0 112.856 -171.424 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.46 ' HB2' HG12 ' A' ' 57' ' ' VAL . 1.9 t60 -82.18 153.6 25.89 Favored 'General case' 0 CA--C 1.563 1.48 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -174.362 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -76.8 8.2 3.94 Favored 'General case' 0 CA--C 1.586 2.352 0 N-CA-C 116.402 2.001 . . . . 0.0 116.402 172.046 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.277 44.3 p 75.81 97.07 0.07 Allowed 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 127.063 2.145 . . . . 0.0 111.681 -178.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.28 4.2 mp 75.27 -46.94 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 C-N-CA 125.565 1.546 . . . . 0.0 114.305 174.41 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.0 mp -77.83 -126.85 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.158 0 CA-C-N 121.565 1.984 . . . . 0.0 112.249 -174.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.1 p -156.84 94.6 1.45 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 122.924 2.602 . . . . 0.0 116.119 178.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 tt -161.28 92.75 0.92 Allowed 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 103.724 -2.695 . . . . 0.0 103.724 173.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.5 m -110.32 116.11 30.88 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.312 -0.868 . . . . 0.0 112.222 -173.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -124.12 137.55 54.54 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 124.242 1.017 . . . . 0.0 109.782 -178.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 98.5 m -68.58 142.39 55.19 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 119.989 -1.694 . . . . 0.0 113.46 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -135.35 -176.75 4.37 Favored 'General case' 0 CA--C 1.565 1.555 0 CA-C-N 113.558 -1.656 . . . . 0.0 113.183 -173.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.6 pp -82.29 161.9 22.47 Favored 'General case' 0 CA--C 1.572 1.799 0 CA-C-O 122.429 1.109 . . . . 0.0 112.807 174.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -77.97 152.99 32.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.213 -0.929 . . . . 0.0 112.713 175.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.62 159.0 30.65 Favored 'General case' 0 CA--C 1.569 1.697 0 CA-C-O 123.972 1.844 . . . . 0.0 115.278 -174.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 56.8 mtt85 -126.53 168.13 14.69 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-N 113.475 -1.693 . . . . 0.0 110.939 -177.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -44.51 135.21 4.87 Favored 'General case' 0 CA--C 1.574 1.884 0 N-CA-C 116.953 2.205 . . . . 0.0 116.953 -173.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.39 6.6 p30 67.88 14.04 9.32 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 116.957 2.206 . . . . 0.0 116.957 -173.497 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.5 t -117.41 146.29 43.54 Favored 'General case' 0 CA--C 1.565 1.546 0 CA-C-O 122.867 1.318 . . . . 0.0 110.56 173.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -60.11 139.68 57.35 Favored 'General case' 0 CA--C 1.571 1.753 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.611 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 28.5 p -141.88 150.74 41.93 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 113.289 -1.778 . . . . 0.0 114.692 -174.596 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.8 t -79.83 109.67 14.47 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 173.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.03 -43.46 64.95 Favored 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -105.23 144.71 31.64 Favored 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 170.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 22.3 p -126.79 139.03 53.41 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.196 -1.565 . . . . 0.0 112.295 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -98.39 -169.24 1.77 Allowed 'General case' 0 CA--C 1.576 1.965 0 CA-C-N 113.098 -1.864 . . . . 0.0 109.513 173.074 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -103.22 62.53 0.79 Allowed 'General case' 0 N--CA 1.499 2.016 0 CA-C-O 123.258 1.504 . . . . 0.0 108.017 174.077 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -162.61 177.4 38.74 Favored Glycine 0 N--CA 1.475 1.272 0 CA-C-N 113.554 -1.657 . . . . 0.0 112.012 -174.165 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.46 HG12 ' HB2' ' A' ' 30' ' ' HIS . 3.4 t -78.34 141.06 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 CA-C-O 123.396 1.569 . . . . 0.0 111.764 -167.194 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -107.54 136.53 47.16 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 114.165 -1.38 . . . . 0.0 112.964 -172.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -68.41 -19.94 64.63 Favored 'General case' 0 CA--C 1.592 2.572 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 172.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.67 111.97 1.21 Allowed 'General case' 0 CA--C 1.575 1.925 0 C-N-CA 128.038 2.535 . . . . 0.0 104.837 -175.409 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 40.2 m -58.64 155.49 29.34 Favored Pre-proline 0 CA--C 1.588 2.442 0 O-C-N 118.946 -2.346 . . . . 0.0 116.75 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -64.2 168.59 12.24 Favored 'Trans proline' 0 CA--C 1.573 2.434 0 C-N-CA 122.691 2.26 . . . . 0.0 115.678 175.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 60.9 m -73.94 150.26 40.91 Favored 'General case' 0 CA--C 1.575 1.94 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -177.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.71 -175.96 1.84 Allowed 'General case' 0 CA--C 1.583 2.23 0 N-CA-C 116.97 2.211 . . . . 0.0 116.97 -174.593 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.46 114.38 1.99 Allowed 'General case' 0 CA--C 1.572 1.826 0 O-C-N 120.474 -1.391 . . . . 0.0 114.306 -179.025 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 80.83 15.61 77.17 Favored Glycine 0 N--CA 1.493 2.489 0 N-CA-C 119.43 2.532 . . . . 0.0 119.43 -174.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 tt -132.75 132.46 42.31 Favored 'General case' 0 CA--C 1.568 1.641 0 CA-C-N 119.024 1.412 . . . . 0.0 108.267 -174.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.07 158.06 15.77 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -173.367 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 16.0 t -94.54 111.56 23.32 Favored 'General case' 0 CA--C 1.568 1.671 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.907 172.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 . . . . . 0 CA--C 1.567 1.619 0 O-C-N 120.452 -1.405 . . . . 0.0 110.818 -175.41 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 . . . . . 0 CA--C 1.574 1.902 0 CA-C-O 122.628 1.204 . . . . 0.0 112.82 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -102.41 169.58 19.65 Favored Glycine 0 N--CA 1.489 2.213 0 O-C-N 120.705 -1.247 . . . . 0.0 115.373 174.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 35.5 mm -110.54 135.46 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 173.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.611 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 23.1 m -63.2 131.1 47.3 Favored 'General case' 0 CA--C 1.57 1.748 0 O-C-N 120.528 -1.357 . . . . 0.0 114.352 173.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 -144.6 148.27 34.15 Favored 'General case' 0 CA--C 1.563 1.48 0 O-C-N 120.731 -1.23 . . . . 0.0 109.718 173.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -96.87 130.18 44.2 Favored 'General case' 0 CA--C 1.565 1.55 0 O-C-N 120.692 -1.255 . . . . 0.0 109.835 176.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 61.8 t . . . . . 0 N--CA 1.501 2.084 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.098 -174.212 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 . . . . . 0 N--CA 1.498 1.957 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -138.08 155.07 49.14 Favored 'General case' 0 CA--C 1.574 1.873 0 CA-C-O 122.401 1.096 . . . . 0.0 110.074 172.564 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -78.11 164.09 25.3 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 119.376 -2.077 . . . . 0.0 114.732 -173.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -73.91 150.18 41.01 Favored 'General case' 0 CA--C 1.573 1.854 0 CA-C-O 122.239 1.019 . . . . 0.0 110.606 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.59 24.76 34.96 Favored Glycine 0 CA--C 1.562 3.027 0 O-C-N 121.484 -0.76 . . . . 0.0 114.819 -170.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -132.95 143.57 49.55 Favored 'General case' 0 CA--C 1.569 1.699 0 C-N-CA 125.632 1.573 . . . . 0.0 108.763 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 34.9 mt -70.92 134.19 47.04 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -174.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.7 p -140.48 152.68 45.81 Favored 'General case' 0 CA--C 1.561 1.373 0 C-N-CA 124.002 0.921 . . . . 0.0 113.124 -174.689 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -85.4 -77.88 0.28 Allowed 'General case' 0 CA--C 1.567 1.616 0 CA-C-O 117.743 -1.122 . . . . 0.0 108.222 172.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -96.35 170.75 9.02 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 121.149 1.795 . . . . 0.0 114.114 174.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.8 m -69.4 -10.69 59.07 Favored 'General case' 0 N--CA 1.508 2.451 0 N-CA-C 117.077 2.251 . . . . 0.0 117.077 174.242 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.41 52.82 2.56 Favored 'General case' 0 CA--C 1.571 1.764 0 CA-C-O 123.554 1.645 . . . . 0.0 114.939 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -141.32 -49.59 0.41 Allowed 'General case' 0 CA--C 1.574 1.878 0 CA-C-N 113.968 -1.469 . . . . 0.0 113.98 -177.154 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 67.4 m -84.19 160.92 20.73 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 116.15 1.907 . . . . 0.0 116.15 -174.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -60.53 -54.24 47.79 Favored 'General case' 0 N--CA 1.504 2.232 0 C-N-CA 124.754 1.222 . . . . 0.0 109.112 171.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.8 t -82.64 92.25 7.12 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 102.07 -3.307 . . . . 0.0 102.07 167.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -72.75 69.19 0.9 Allowed 'General case' 0 N--CA 1.497 1.922 0 CA-C-O 124.64 2.162 . . . . 0.0 116.435 -170.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 43.9 t -145.44 96.39 2.82 Favored 'General case' 0 CA--C 1.557 1.225 0 CA-C-N 112.643 -2.071 . . . . 0.0 110.155 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 15.6 t -78.08 115.08 17.55 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 103.802 -2.666 . . . . 0.0 103.802 171.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -98.84 123.7 43.26 Favored 'General case' 0 CA--C 1.566 1.56 0 CA-C-O 123.156 1.455 . . . . 0.0 114.538 -170.387 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.55 ' HB2' HG12 ' A' ' 57' ' ' VAL . 12.2 t-80 -87.23 116.77 25.54 Favored 'General case' 0 CA--C 1.562 1.418 0 CA-C-N 114.026 -1.443 . . . . 0.0 113.603 -174.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -83.42 56.35 3.54 Favored 'General case' 0 CA--C 1.581 2.143 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 174.221 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 17.7 p 77.18 109.73 0.07 Allowed 'General case' 0 N--CA 1.505 2.308 0 N-CA-C 119.454 3.131 . . . . 0.0 119.454 171.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.302 4.7 mp 53.52 -87.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 C-N-CA 126.79 2.036 . . . . 0.0 115.766 172.238 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.7 tp -103.37 88.1 3.03 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 175.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 54.4 p -136.2 150.5 49.04 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 116.303 1.964 . . . . 0.0 116.303 -172.497 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 46.2 tp -80.37 117.09 20.81 Favored 'General case' 0 CA--C 1.569 1.709 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 173.187 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.9 m -92.6 137.2 32.57 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 122.964 1.364 . . . . 0.0 114.515 -171.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.8 ttt180 -134.53 137.35 43.76 Favored 'General case' 0 N--CA 1.495 1.8 0 C-N-CA 124.055 0.942 . . . . 0.0 110.181 -174.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 67.1 m -65.98 148.23 52.12 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 119.606 -1.934 . . . . 0.0 114.946 -177.297 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.67 -179.47 5.94 Favored 'General case' 0 CA--C 1.57 1.74 0 CA-C-N 113.488 -1.687 . . . . 0.0 112.83 -174.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.2 mt -81.65 138.91 35.24 Favored 'General case' 0 CA--C 1.566 1.579 0 O-C-N 121.069 -1.02 . . . . 0.0 112.932 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.9 pttt -70.67 134.5 47.58 Favored 'General case' 0 CA--C 1.573 1.852 0 O-C-N 121.606 -0.684 . . . . 0.0 110.3 173.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.41 154.73 38.66 Favored 'General case' 0 CA--C 1.561 1.389 0 N-CA-C 118.37 2.73 . . . . 0.0 118.37 -171.122 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -113.09 171.73 7.37 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 112.569 -2.105 . . . . 0.0 112.722 -177.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -58.94 125.01 21.79 Favored 'General case' 0 CA--C 1.568 1.669 0 CA-C-N 114.838 -1.073 . . . . 0.0 113.009 -174.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 85.51 18.22 0.12 Allowed 'General case' 0 CA--C 1.586 2.338 0 C-N-CA 125.956 1.702 . . . . 0.0 114.177 -173.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.3 t -119.77 151.79 38.24 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 119.953 -1.717 . . . . 0.0 112.312 175.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -74.51 120.71 20.44 Favored 'General case' 0 CA--C 1.575 1.918 0 CA-C-O 123.755 1.74 . . . . 0.0 112.534 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.495 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 19.3 p -122.86 152.53 40.66 Favored 'General case' 0 CA--C 1.562 1.426 0 C-N-CA 127.146 2.178 . . . . 0.0 112.482 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 65.9 m -75.57 123.4 25.43 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.403 -1.436 . . . . 0.0 107.804 173.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.82 -49.33 25.73 Favored 'General case' 0 CA--C 1.565 1.525 0 N-CA-C 116.884 2.179 . . . . 0.0 116.884 -172.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -91.97 151.84 20.31 Favored 'General case' 0 CA--C 1.566 1.591 0 CA-C-N 118.758 0.708 . . . . 0.0 109.867 173.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.6 p -121.0 146.58 46.54 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 124.411 2.053 . . . . 0.0 110.588 174.025 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -98.47 -126.29 0.16 Allowed 'General case' 0 CA--C 1.569 1.711 0 CA-C-N 112.469 -2.15 . . . . 0.0 105.884 174.103 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -149.17 70.83 1.1 Allowed 'General case' 0 CA--C 1.564 1.511 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 169.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 175.47 -135.78 3.14 Favored Glycine 0 N--CA 1.483 1.819 0 CA-C-N 115.644 -0.707 . . . . 0.0 113.999 -176.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.55 HG12 ' HB2' ' A' ' 30' ' ' HIS . 3.4 t -79.76 144.22 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.175 0 CA-C-O 122.25 1.024 . . . . 0.0 112.196 -172.792 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -123.6 135.84 54.18 Favored 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 123.515 0.726 . . . . 0.0 112.56 -173.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -60.42 -51.08 71.02 Favored 'General case' 0 N--CA 1.503 2.218 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 177.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -135.41 122.02 20.79 Favored 'General case' 0 CA--C 1.559 1.311 0 N-CA-C 103.892 -2.633 . . . . 0.0 103.892 174.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 97.2 m -43.91 130.66 4.2 Favored Pre-proline 0 CA--C 1.592 2.588 0 N-CA-C 117.852 2.538 . . . . 0.0 117.852 -174.44 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -77.65 60.75 7.28 Favored 'Trans proline' 0 CA--C 1.576 2.614 0 C-N-CA 123.179 2.586 . . . . 0.0 118.637 -173.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 37.8 m 61.7 163.92 0.08 Allowed 'General case' 0 CA--C 1.582 2.198 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.42 174.07 11.83 Favored 'General case' 0 CA--C 1.575 1.94 0 N-CA-C 115.19 1.552 . . . . 0.0 115.19 178.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.99 108.65 1.26 Allowed 'General case' 0 CA--C 1.574 1.868 0 O-C-N 120.476 -1.39 . . . . 0.0 112.469 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 93.18 27.7 13.07 Favored Glycine 0 N--CA 1.497 2.709 0 N-CA-C 118.036 1.974 . . . . 0.0 118.036 -173.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 12.3 tp -140.9 138.42 33.87 Favored 'General case' 0 CA--C 1.567 1.614 0 CA-C-N 118.794 1.297 . . . . 0.0 110.225 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -98.74 154.1 18.23 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.708 -1.245 . . . . 0.0 112.828 -176.1 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.2 t -94.77 146.62 24.06 Favored 'General case' 0 CA--C 1.575 1.911 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.943 172.241 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 . . . . . 0 N--CA 1.5 2.045 0 O-C-N 120.381 -1.449 . . . . 0.0 110.378 178.45 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 . . . . . 0 CA--C 1.574 1.902 0 CA-C-O 122.27 1.033 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.22 162.33 23.85 Favored Glycine 0 N--CA 1.495 2.576 0 N-CA-C 119.116 2.406 . . . . 0.0 119.116 -174.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 23.2 mm -95.96 136.76 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 O-C-N 120.975 -1.309 . . . . 0.0 110.774 -171.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.495 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 53.2 m -67.85 124.22 22.72 Favored 'General case' 0 CA--C 1.569 1.691 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 174.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -144.12 159.79 42.04 Favored 'General case' 0 CA--C 1.565 1.525 0 CA-C-O 123.328 1.537 . . . . 0.0 111.642 174.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -99.44 132.64 44.63 Favored 'General case' 0 CA--C 1.564 1.512 0 O-C-N 120.855 -1.153 . . . . 0.0 110.7 175.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 59.9 t . . . . . 0 CA--C 1.588 2.43 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -179.372 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.58 2.128 0 N-CA-C 118.017 2.599 . . . . 0.0 118.017 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 mt -131.54 146.48 52.24 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 123.568 1.651 . . . . 0.0 113.838 175.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -80.51 162.6 24.27 Favored 'General case' 0 CA--C 1.567 1.616 0 CA-C-N 114.193 -1.367 . . . . 0.0 113.47 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -76.72 131.78 38.95 Favored 'General case' 0 CA--C 1.578 2.041 0 N-CA-C 107.788 -1.189 . . . . 0.0 107.788 173.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 101.66 26.7 7.48 Favored Glycine 0 CA--C 1.561 2.948 0 CA-C-N 115.766 -0.652 . . . . 0.0 114.469 -171.138 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -129.24 139.46 51.83 Favored 'General case' 0 CA--C 1.566 1.574 0 C-N-CA 125.121 1.368 . . . . 0.0 109.243 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.0 mp -68.08 124.96 24.86 Favored 'General case' 0 CA--C 1.574 1.868 0 O-C-N 121.152 -0.967 . . . . 0.0 112.191 -178.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 6.8 p -131.39 152.1 50.94 Favored 'General case' 0 CA--C 1.561 1.399 0 C-N-CA 124.229 1.011 . . . . 0.0 113.072 -174.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 97.7 mt -84.09 -74.97 0.36 Allowed 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 118.092 -0.956 . . . . 0.0 108.917 174.197 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -98.57 172.93 7.18 Favored 'General case' 0 N--CA 1.501 2.09 0 CA-C-N 120.998 1.726 . . . . 0.0 113.331 173.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.9 m -71.92 -9.67 58.68 Favored 'General case' 0 N--CA 1.508 2.463 0 N-CA-C 116.639 2.089 . . . . 0.0 116.639 173.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.72 4.2 12.18 Favored 'General case' 0 CA--C 1.572 1.816 0 N-CA-C 118.27 2.693 . . . . 0.0 118.27 176.132 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -97.77 -35.59 10.49 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 115.346 1.609 . . . . 0.0 115.346 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 71.4 m -81.05 155.77 26.17 Favored 'General case' 0 CA--C 1.564 1.498 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 177.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -62.96 -50.9 68.98 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.385 -0.822 . . . . 0.0 110.089 172.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.0 p -82.46 97.39 8.38 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 102.851 -3.018 . . . . 0.0 102.851 167.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -70.85 80.55 0.63 Allowed 'General case' 0 N--CA 1.498 1.94 0 CA-C-O 124.6 2.143 . . . . 0.0 115.354 -171.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 41.0 t -158.28 93.12 1.2 Allowed 'General case' 0 CA--C 1.557 1.218 0 CA-C-N 112.248 -2.251 . . . . 0.0 110.699 -176.527 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.8 t -80.22 113.98 18.79 Favored 'General case' 0 CA--C 1.56 1.348 0 N-CA-C 104.933 -2.247 . . . . 0.0 104.933 171.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 46.7 tp60 -91.99 115.79 28.37 Favored 'General case' 0 CA--C 1.558 1.287 0 CA-C-O 122.347 1.07 . . . . 0.0 113.884 -172.124 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.515 ' HB2' HG12 ' A' ' 57' ' ' VAL . 24.3 t-80 -81.1 117.28 21.54 Favored 'General case' 0 CA--C 1.562 1.432 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.734 176.544 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -72.15 56.83 0.34 Allowed 'General case' 0 CA--C 1.581 2.163 0 N-CA-C 116.923 2.194 . . . . 0.0 116.923 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 44.3 p 61.25 69.13 0.68 Allowed 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 126.037 1.735 . . . . 0.0 115.071 173.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.331 3.7 mp 71.1 -32.84 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.534 0 C-N-CA 125.191 1.396 . . . . 0.0 113.762 -179.079 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.1 tp -53.07 -20.95 4.06 Favored 'General case' 0 CA--C 1.586 2.364 0 N-CA-C 117.627 2.454 . . . . 0.0 117.627 174.572 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.288 26.3 p 77.93 1.44 2.83 Favored 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 121.692 3.96 . . . . 0.0 121.692 172.455 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.5 tp -73.64 96.25 2.45 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 121.711 2.05 . . . . 0.0 106.76 172.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.9 m -97.68 107.37 19.85 Favored 'General case' 0 CA--C 1.56 1.344 0 CA-C-O 123.139 1.447 . . . . 0.0 111.648 -171.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -131.22 132.83 44.93 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-N 114.546 -1.206 . . . . 0.0 108.98 -174.111 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 99.5 m -62.42 150.56 39.53 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 122.402 2.365 . . . . 0.0 116.504 -174.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -132.61 173.41 11.36 Favored 'General case' 0 CA--C 1.568 1.658 0 CA-C-N 114.162 -1.381 . . . . 0.0 113.842 -174.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 26.6 tp -85.47 146.19 27.07 Favored 'General case' 0 CA--C 1.569 1.677 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -174.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -69.95 143.32 52.7 Favored 'General case' 0 CA--C 1.577 2.001 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 175.539 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.492 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . . . -78.93 169.61 17.96 Favored 'General case' 0 CA--C 1.579 2.077 0 N-CA-C 118.272 2.694 . . . . 0.0 118.272 -173.147 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 46.3 mtp180 -112.66 173.87 6.17 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 113.19 -1.823 . . . . 0.0 112.57 -178.469 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -64.2 136.76 57.51 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 122.083 0.944 . . . . 0.0 113.134 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 70.98 23.31 4.29 Favored 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 124.93 1.292 . . . . 0.0 114.118 -173.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.9 t -121.87 148.54 44.59 Favored 'General case' 0 CA--C 1.558 1.266 0 CA-C-O 122.596 1.189 . . . . 0.0 110.263 174.511 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -67.53 133.49 49.56 Favored 'General case' 0 CA--C 1.576 1.953 0 CA-C-O 123.749 1.738 . . . . 0.0 112.137 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 87' ' ' CYS . 22.3 p -137.41 156.43 48.2 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 112.855 -1.975 . . . . 0.0 112.552 -174.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 92.9 p -81.64 117.57 22.1 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 172.119 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.36 -55.31 7.3 Favored 'General case' 0 CA--C 1.583 2.244 0 CA-C-O 122.813 1.292 . . . . 0.0 108.181 172.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -155.24 127.64 7.82 Favored 'General case' 0 CA--C 1.573 1.838 0 N-CA-C 101.795 -3.409 . . . . 0.0 101.795 169.822 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.4 m -88.39 -70.43 0.64 Allowed 'General case' 0 CA--C 1.568 1.651 0 O-C-N 119.434 -2.042 . . . . 0.0 106.125 171.217 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -152.59 -72.67 0.14 Allowed 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 124.694 1.198 . . . . 0.0 109.816 173.284 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -162.43 -43.45 0.04 OUTLIER 'General case' 0 CA--C 1.579 2.084 0 C-N-CA 125.128 1.371 . . . . 0.0 113.851 -173.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -96.95 -120.44 3.94 Favored Glycine 0 N--CA 1.485 1.942 0 N-CA-C 116.94 1.536 . . . . 0.0 116.94 -172.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.515 HG12 ' HB2' ' A' ' 30' ' ' HIS . 3.1 t -82.16 141.04 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 CA-C-O 122.415 1.102 . . . . 0.0 111.11 -175.427 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 17.0 m-30 -122.65 148.84 44.79 Favored 'General case' 0 CA--C 1.559 1.317 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 -171.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -77.97 -9.05 58.91 Favored 'General case' 0 CA--C 1.585 2.311 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 173.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.61 140.04 9.45 Favored 'General case' 0 CA--C 1.571 1.752 0 C-N-CA 126.68 1.992 . . . . 0.0 106.686 -174.019 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 96.3 m -82.64 156.26 68.13 Favored Pre-proline 0 CA--C 1.581 2.135 0 N-CA-C 116.706 2.113 . . . . 0.0 116.706 177.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.51 171.52 16.96 Favored 'Trans proline' 0 CA--C 1.571 2.361 0 C-N-CA 122.704 2.269 . . . . 0.0 112.989 173.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.492 ' SG ' ' HB3' ' A' ' 43' ' ' ALA . 5.3 m -85.85 170.07 12.74 Favored 'General case' 0 CA--C 1.568 1.666 0 CA-C-O 123.751 1.739 . . . . 0.0 115.042 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -59.73 154.68 17.53 Favored 'General case' 0 CA--C 1.572 1.824 0 N-CA-C 115.805 1.78 . . . . 0.0 115.805 178.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -65.62 113.37 4.18 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 122.62 1.2 . . . . 0.0 112.427 -174.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 115.43 -27.08 8.66 Favored Glycine 0 N--CA 1.497 2.756 0 CA-C-N 114.099 -1.41 . . . . 0.0 116.355 -172.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 11.7 tp -97.42 138.81 34.29 Favored 'General case' 0 CA--C 1.569 1.688 0 CA-C-N 118.504 1.152 . . . . 0.0 110.936 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -97.19 148.82 22.69 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.424 -1.423 . . . . 0.0 113.443 -174.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 16.7 t -94.37 100.82 12.78 Favored 'General case' 0 CA--C 1.569 1.681 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.094 173.093 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 . . . . . 0 N--CA 1.497 1.917 0 CA-C-N 120.587 1.54 . . . . 0.0 111.66 -176.767 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 123.079 1.418 . . . . 0.0 110.159 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -166.18 154.73 25.5 Favored Glycine 0 N--CA 1.488 2.165 0 O-C-N 121.075 -1.016 . . . . 0.0 112.936 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.7 mm -94.19 138.43 20.59 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.161 0 CA-C-N 119.44 1.62 . . . . 0.0 109.188 -176.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 61.2 m -74.73 123.41 24.88 Favored 'General case' 0 CA--C 1.563 1.461 0 N-CA-C 116.177 1.917 . . . . 0.0 116.177 178.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -141.11 158.62 43.66 Favored 'General case' 0 CA--C 1.561 1.373 0 CA-C-O 123.488 1.614 . . . . 0.0 111.483 179.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -98.15 40.7 1.16 Allowed 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 174.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.0 t . . . . . 0 N--CA 1.502 2.14 0 C-N-CA 127.012 2.125 . . . . 0.0 113.811 174.897 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 55.7 m-80 . . . . . 0 CA--C 1.573 1.853 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mp -131.0 136.44 48.51 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.21 -1.557 . . . . 0.0 112.226 174.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -84.97 172.41 11.35 Favored 'General case' 0 CA--C 1.572 1.814 0 O-C-N 121.365 -0.835 . . . . 0.0 112.887 174.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -77.01 114.54 15.92 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 173.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 135.25 -8.97 4.41 Favored Glycine 0 CA--C 1.56 2.883 0 CA-C-N 114.298 -1.319 . . . . 0.0 115.627 -172.249 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -114.76 154.65 28.14 Favored 'General case' 0 CA--C 1.569 1.675 0 CA-C-N 120.084 1.942 . . . . 0.0 112.162 -177.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -81.83 147.95 29.1 Favored 'General case' 0 CA--C 1.574 1.866 0 CA-C-O 122.114 0.959 . . . . 0.0 113.303 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.6 p -137.55 -179.03 5.5 Favored 'General case' 0 CA--C 1.575 1.906 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -174.489 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.6 tp -99.29 -74.14 0.6 Allowed 'General case' 0 CA--C 1.58 2.121 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 171.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -94.87 -173.15 2.9 Favored 'General case' 0 N--CA 1.501 2.12 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 174.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.8 m -78.05 -31.93 50.59 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 119.79 -1.819 . . . . 0.0 114.703 172.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.83 65.43 4.99 Favored 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 124.706 2.193 . . . . 0.0 111.608 173.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -139.96 -50.17 0.48 Allowed 'General case' 0 CA--C 1.566 1.584 0 CA-C-N 111.89 -2.414 . . . . 0.0 111.258 -174.28 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 95.4 m -81.27 140.8 34.64 Favored 'General case' 0 CA--C 1.564 1.518 0 O-C-N 121.162 -0.961 . . . . 0.0 109.997 173.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -53.35 -30.3 38.69 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 118.694 2.85 . . . . 0.0 118.694 -173.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -79.78 -76.68 0.21 Allowed 'General case' 0 CA--C 1.574 1.879 0 CA-C-N 118.219 0.463 . . . . 0.0 110.516 173.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -173.07 -39.67 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.35 0 N-CA-C 116.565 2.061 . . . . 0.0 116.565 -176.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.3 t -97.71 110.52 23.07 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 119.711 3.226 . . . . 0.0 119.711 -169.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 22.5 t -95.41 118.87 32.93 Favored 'General case' 0 CA--C 1.562 1.409 0 N-CA-C 104.436 -2.431 . . . . 0.0 104.436 168.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.99 114.28 27.45 Favored 'General case' 0 CA--C 1.57 1.731 0 CA-C-O 123.185 1.469 . . . . 0.0 114.672 -172.128 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.697 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.1 t60 -82.52 155.54 24.49 Favored 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 126.432 1.893 . . . . 0.0 112.348 177.607 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.2 p30 -81.88 40.15 0.59 Allowed 'General case' 0 CA--C 1.587 2.396 0 O-C-N 120.434 -1.416 . . . . 0.0 114.21 172.179 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 48.7 p 63.54 90.02 0.08 Allowed 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 126.429 1.892 . . . . 0.0 113.68 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.301 3.2 mp 69.31 -38.04 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 174.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.3 mt -71.09 -87.41 0.02 OUTLIER 'General case' 0 CA--C 1.576 1.956 0 CA-C-N 122.405 2.366 . . . . 0.0 112.228 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 91.9 p -155.67 -131.25 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.022 0 CA-C-N 122.029 2.195 . . . . 0.0 114.005 174.091 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 20.7 tp 43.76 75.83 0.09 Allowed 'General case' 0 N--CA 1.502 2.125 0 C-N-CA 125.911 1.684 . . . . 0.0 115.113 -174.195 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.671 ' HB3' HG11 ' A' ' 57' ' ' VAL . 18.7 m -98.81 86.61 3.55 Favored 'General case' 0 CA--C 1.565 1.531 0 CA-C-O 122.205 1.002 . . . . 0.0 110.69 -174.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -120.36 127.66 52.52 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.653 1.181 . . . . 0.0 109.977 -174.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 74.8 m -66.6 140.42 57.94 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 116.281 1.956 . . . . 0.0 116.281 -174.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -142.34 173.17 11.77 Favored 'General case' 0 CA--C 1.565 1.554 0 CA-C-N 113.312 -1.767 . . . . 0.0 114.314 -173.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.6 pp -84.9 165.52 17.6 Favored 'General case' 0 CA--C 1.573 1.831 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 178.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -74.35 146.69 42.84 Favored 'General case' 0 CA--C 1.574 1.877 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.41 164.04 25.84 Favored 'General case' 0 CA--C 1.571 1.761 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -174.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 65.3 mtt180 -128.87 165.28 21.34 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 122.556 1.17 . . . . 0.0 112.338 -175.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -43.09 126.77 4.08 Favored 'General case' 0 CA--C 1.568 1.656 0 N-CA-C 117.3 2.333 . . . . 0.0 117.3 -172.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 72.39 17.97 4.66 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 115.248 1.573 . . . . 0.0 115.248 -174.09 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.7 t -117.75 150.32 39.3 Favored 'General case' 0 CA--C 1.565 1.533 0 CA-C-O 122.758 1.266 . . . . 0.0 110.619 174.131 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -65.33 122.0 16.12 Favored 'General case' 0 CA--C 1.573 1.85 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 -175.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.422 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 4.6 t -113.03 137.34 51.56 Favored 'General case' 0 CA--C 1.558 1.275 0 CA-C-N 113.489 -1.687 . . . . 0.0 111.232 174.2 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.1 t -99.68 115.68 30.03 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 172.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.19 -22.33 45.11 Favored 'General case' 0 CA--C 1.572 1.789 0 N-CA-C 115.997 1.851 . . . . 0.0 115.997 -178.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -129.33 154.64 46.68 Favored 'General case' 0 CA--C 1.578 2.027 0 N-CA-C 117.431 2.382 . . . . 0.0 117.431 -176.226 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.6 t 131.47 -152.51 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.523 2 N-CA-C 97.042 -5.17 . . . . 0.0 97.042 -171.552 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.653 3.6 mt 176.02 -69.36 0.01 OUTLIER 'General case' 0 N--CA 1.521 3.075 1 O-C-N 113.353 -5.842 . . . . 0.0 110.608 160.858 . . . . . . . . 3 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -78.8 -26.81 44.35 Favored 'General case' 0 CA--C 1.577 1.997 0 CA-C-N 112.433 -2.167 . . . . 0.0 108.883 168.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -81.97 159.76 40.05 Favored Glycine 0 CA--C 1.55 2.219 0 N-CA-C 107.619 -2.193 . . . . 0.0 107.619 170.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.697 HG12 ' HB2' ' A' ' 30' ' ' HIS . 93.6 t -70.87 135.67 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 CA-C-O 123.715 1.721 . . . . 0.0 112.028 -163.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 -66.7 124.23 22.3 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 113.014 -1.903 . . . . 0.0 114.779 -172.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -69.3 -40.63 77.57 Favored 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 114.787 1.402 . . . . 0.0 114.787 -174.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -149.95 103.84 3.24 Favored 'General case' 0 CA--C 1.569 1.684 0 N-CA-C 101.593 -3.484 . . . . 0.0 101.593 172.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 57.2 m -39.91 127.61 1.58 Allowed Pre-proline 0 CA--C 1.587 2.396 0 N-CA-C 116.913 2.19 . . . . 0.0 116.913 -173.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -47.83 166.33 0.12 Allowed 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 123.52 2.813 . . . . 0.0 119.266 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 58.4 m -68.01 146.09 53.86 Favored 'General case' 0 CA--C 1.569 1.686 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -178.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -178.72 1.42 Allowed 'General case' 0 CA--C 1.577 2.011 0 N-CA-C 115.268 1.581 . . . . 0.0 115.268 -176.471 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -60.84 112.45 2.05 Favored 'General case' 0 CA--C 1.571 1.76 0 O-C-N 120.349 -1.469 . . . . 0.0 113.096 -175.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.13 -20.65 35.17 Favored Glycine 0 N--CA 1.496 2.699 0 N-CA-C 118.629 2.212 . . . . 0.0 118.629 -173.609 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.1 mp -106.35 151.93 24.23 Favored 'General case' 0 CA--C 1.569 1.689 0 CA-C-N 118.841 1.32 . . . . 0.0 112.183 -178.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.96 158.26 17.87 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-O 122.368 1.08 . . . . 0.0 113.611 -176.598 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 6.1 t -90.71 120.04 31.43 Favored 'General case' 0 CA--C 1.57 1.745 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.526 173.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.582 2.193 0 CA-C-N 120.23 1.377 . . . . 0.0 111.775 -174.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.3 m-30 . . . . . 0 CA--C 1.57 1.716 0 CA-C-O 123.094 1.426 . . . . 0.0 110.541 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -139.39 -155.68 6.71 Favored Glycine 0 N--CA 1.48 1.575 0 O-C-N 120.909 -1.119 . . . . 0.0 114.555 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.9 mm -128.97 142.64 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.422 ' SG ' ' HB2' ' A' ' 49' ' ' CYS . 35.7 m -70.86 129.45 39.09 Favored 'General case' 0 CA--C 1.564 1.491 0 O-C-N 120.561 -1.337 . . . . 0.0 113.017 173.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 63.6 m-70 -140.46 155.81 46.57 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 123.203 1.478 . . . . 0.0 111.38 176.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -95.33 128.52 42.24 Favored 'General case' 0 CA--C 1.562 1.429 0 CA-C-O 122.367 1.079 . . . . 0.0 110.607 -176.133 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 9.9 m . . . . . 0 CA--C 1.579 2.072 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -174.792 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.375 0.0 OUTLIER . . . . . 0 CA--C 1.584 2.254 0 CA-C-O 122.628 1.204 . . . . 0.0 111.944 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.86 158.97 38.74 Favored 'General case' 0 CA--C 1.573 1.858 0 CA-C-O 122.989 1.376 . . . . 0.0 111.786 173.553 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -80.47 165.33 22.28 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.097 -1.627 . . . . 0.0 114.456 -174.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.89 123.69 26.1 Favored 'General case' 0 CA--C 1.574 1.887 0 O-C-N 121.44 -0.787 . . . . 0.0 111.036 -179.217 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 129.0 2.37 5.62 Favored Glycine 0 CA--C 1.557 2.677 0 N-CA-C 117.371 1.708 . . . . 0.0 117.371 -173.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -121.71 155.49 35.1 Favored 'General case' 0 CA--C 1.572 1.801 0 CA-C-N 119.895 1.847 . . . . 0.0 112.0 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.4 tt -71.19 137.64 48.89 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -174.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -125.59 176.43 6.87 Favored 'General case' 0 CA--C 1.571 1.78 0 N-CA-C 115.459 1.651 . . . . 0.0 115.459 -174.83 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.4 mp -110.11 -75.85 0.62 Allowed 'General case' 0 CA--C 1.577 1.993 0 N-CA-C 104.463 -2.421 . . . . 0.0 104.463 169.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -96.19 -178.65 4.39 Favored 'General case' 0 CA--C 1.584 2.264 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 172.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.8 m -86.82 -19.49 28.91 Favored 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 116.617 2.081 . . . . 0.0 116.617 174.25 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.33 13.91 1.07 Allowed 'General case' 0 CA--C 1.578 2.051 0 N-CA-C 117.539 2.422 . . . . 0.0 117.539 174.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -95.22 -27.25 15.61 Favored 'General case' 0 CA--C 1.568 1.641 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.2 m -80.44 166.72 20.97 Favored 'General case' 0 CA--C 1.58 2.113 0 CA-C-N 120.875 1.671 . . . . 0.0 113.803 177.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.9 mtpp -67.65 -59.77 3.07 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.432 -1.417 . . . . 0.0 108.358 172.023 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.2 p -82.74 100.13 10.08 Favored 'General case' 0 CA--C 1.57 1.718 0 N-CA-C 102.891 -3.003 . . . . 0.0 102.891 168.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -68.5 79.72 0.27 Allowed 'General case' 0 N--CA 1.498 1.972 0 CA-C-O 125.232 2.444 . . . . 0.0 116.233 -171.023 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 t -146.23 95.88 2.69 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-N 111.646 -2.525 . . . . 0.0 110.188 -174.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.3 t -93.95 123.75 37.52 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 107.138 -1.431 . . . . 0.0 107.138 171.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -76.35 149.16 37.04 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 122.784 1.278 . . . . 0.0 110.427 174.607 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.422 ' CE1' ' H ' ' A' ' 32' ' ' THR . 0.3 OUTLIER -61.24 155.5 20.83 Favored 'General case' 0 CA--C 1.574 1.873 1 N-CA-C 129.105 6.706 . . . . 0.0 129.105 -170.664 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -100.71 -34.34 9.89 Favored 'General case' 0 CA--C 1.578 2.024 0 CA-C-N 110.215 -3.175 . . . . 0.0 119.367 173.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.422 ' H ' ' CE1' ' A' ' 30' ' ' HIS . 0.3 OUTLIER -89.19 -55.43 3.68 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.415 -1.428 . . . . 0.0 113.79 -172.488 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 9.2 pt -76.81 -52.68 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.265 0 CA-C-N 120.48 1.491 . . . . 0.0 110.893 173.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.3 tt -95.88 118.72 33.06 Favored 'General case' 0 CA--C 1.565 1.555 0 N-CA-C 103.544 -2.762 . . . . 0.0 103.544 171.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.4 p -91.21 61.74 4.58 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 118.726 2.861 . . . . 0.0 118.726 -172.494 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.7 tp -173.72 110.48 0.17 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 174.234 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.2 m -91.11 122.05 33.42 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 121.026 1.739 . . . . 0.0 111.72 -174.139 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -136.48 147.38 47.13 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-N 114.31 -1.314 . . . . 0.0 111.55 -172.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 89.4 m -65.49 135.58 55.34 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 118.278 -2.764 . . . . 0.0 111.357 174.068 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -134.02 -176.7 4.27 Favored 'General case' 0 CA--C 1.566 1.575 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -173.014 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -91.51 162.02 14.72 Favored 'General case' 0 CA--C 1.573 1.857 0 CA-C-O 122.524 1.155 . . . . 0.0 113.745 177.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -81.83 153.07 26.61 Favored 'General case' 0 CA--C 1.572 1.816 0 CA-C-O 121.529 0.681 . . . . 0.0 112.354 174.095 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.49 158.84 28.5 Favored 'General case' 0 CA--C 1.567 1.631 0 N-CA-C 115.332 1.604 . . . . 0.0 115.332 -176.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -118.21 174.2 6.36 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 114.383 -1.28 . . . . 0.0 111.897 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -48.96 133.96 17.48 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 116.795 2.146 . . . . 0.0 116.795 -172.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.9 m120 71.57 15.47 6.06 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 -174.496 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.1 t -113.7 152.61 30.23 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 120.778 -1.201 . . . . 0.0 111.766 174.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -64.72 136.9 57.44 Favored 'General case' 0 CA--C 1.568 1.64 0 CA-C-O 123.313 1.53 . . . . 0.0 112.777 174.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.434 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 24.6 p -136.26 143.25 44.16 Favored 'General case' 0 CA--C 1.562 1.409 0 CA-C-N 112.911 -1.95 . . . . 0.0 112.241 -177.266 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 72.5 m -77.83 99.53 5.97 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-O 122.098 0.952 . . . . 0.0 108.787 177.166 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -75.74 -47.14 27.24 Favored 'General case' 0 CA--C 1.567 1.626 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 -173.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -79.17 -40.27 31.3 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 176.311 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.2 p 58.96 164.18 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.091 0 CA-C-O 124.332 2.015 . . . . 0.0 114.367 -174.378 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.74 -166.53 1.73 Allowed 'General case' 0 CA--C 1.566 1.561 0 CA-C-O 123.466 1.603 . . . . 0.0 108.916 173.291 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -96.16 68.37 2.66 Favored 'General case' 0 CA--C 1.576 1.96 0 N-CA-C 104.962 -2.236 . . . . 0.0 104.962 171.639 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 178.0 -165.75 35.45 Favored Glycine 0 N--CA 1.484 1.887 0 N-CA-C 116.474 1.35 . . . . 0.0 116.474 -173.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 2.8 t -77.89 146.62 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 CA-C-O 122.257 1.027 . . . . 0.0 111.594 -171.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -110.34 137.01 48.64 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -172.605 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -61.44 -52.54 64.12 Favored 'General case' 0 CA--C 1.579 2.085 0 CA-C-N 114.075 -1.42 . . . . 0.0 111.846 173.204 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -140.71 109.08 5.83 Favored 'General case' 0 CA--C 1.566 1.578 0 N-CA-C 104.084 -2.562 . . . . 0.0 104.084 173.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 42.8 m -48.94 156.89 0.85 Allowed Pre-proline 0 CA--C 1.587 2.393 0 N-CA-C 118.027 2.602 . . . . 0.0 118.027 -177.276 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -60.25 170.84 3.64 Favored 'Trans proline' 0 CA--C 1.573 2.43 0 C-N-CA 122.678 2.252 . . . . 0.0 116.179 177.258 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 62.5 m -73.16 149.72 42.74 Favored 'General case' 0 CA--C 1.571 1.773 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -70.48 171.98 9.21 Favored 'General case' 0 CA--C 1.577 2.003 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 -58.94 112.95 1.85 Allowed 'General case' 0 CA--C 1.576 1.967 0 O-C-N 120.551 -1.343 . . . . 0.0 113.388 -177.364 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 112.84 -21.9 17.55 Favored Glycine 0 N--CA 1.496 2.659 0 N-CA-C 117.751 1.86 . . . . 0.0 117.751 -173.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.7 mp -111.5 148.75 32.5 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 119.521 1.66 . . . . 0.0 111.718 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.89 153.19 23.88 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 122.22 1.01 . . . . 0.0 113.106 -177.469 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 7.4 t -95.21 123.95 38.98 Favored 'General case' 0 CA--C 1.569 1.678 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.529 173.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 . . . . . 0 N--CA 1.506 2.371 0 O-C-N 119.936 -1.727 . . . . 0.0 111.404 178.236 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 . . . . . 0 CA--C 1.56 1.354 0 CA-C-O 122.337 1.065 . . . . 0.0 109.894 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -98.22 -178.7 32.94 Favored Glycine 0 N--CA 1.485 1.921 0 N-CA-C 115.456 0.943 . . . . 0.0 115.456 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 32.9 mm -108.9 140.9 25.75 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 171.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.434 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 57.8 m -69.7 124.47 24.05 Favored 'General case' 0 CA--C 1.566 1.561 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 174.404 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 78.8 m-70 -144.69 155.75 43.74 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 122.805 1.288 . . . . 0.0 112.19 175.189 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -96.58 139.07 33.2 Favored 'General case' 0 CA--C 1.567 1.603 0 O-C-N 121.096 -1.003 . . . . 0.0 111.208 175.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.499 1.994 0 CA-C-O 122.675 1.226 . . . . 0.0 108.447 -179.749 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.7 p30 . . . . . 0 CA--C 1.58 2.104 0 N-CA-C 117.01 2.226 . . . . 0.0 117.01 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.8 tp -107.16 127.42 53.49 Favored 'General case' 0 CA--C 1.575 1.918 0 O-C-N 118.96 -2.337 . . . . 0.0 112.502 -175.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -81.03 172.13 14.11 Favored 'General case' 0 CA--C 1.575 1.922 0 O-C-N 119.702 -1.874 . . . . 0.0 114.522 179.354 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -67.37 143.7 56.2 Favored 'General case' 0 CA--C 1.569 1.674 0 C-N-CA 123.973 0.909 . . . . 0.0 112.006 176.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 98.33 -1.8 59.02 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 117.352 1.701 . . . . 0.0 117.352 -173.223 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -112.36 149.26 32.73 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-N 118.943 1.372 . . . . 0.0 111.701 -178.125 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.4 tp -70.67 130.25 41.27 Favored 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -177.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 22.0 p -132.38 150.58 52.13 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.93 0.892 . . . . 0.0 112.79 -178.311 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.1 tp -84.29 -78.62 0.23 Allowed 'General case' 0 CA--C 1.57 1.728 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 172.382 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 -94.71 170.19 9.63 Favored 'General case' 0 CA--C 1.57 1.747 0 CA-C-N 120.012 1.278 . . . . 0.0 113.684 174.015 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.2 p -69.62 -15.33 63.18 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 171.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.6 40.96 0.31 Allowed 'General case' 0 CA--C 1.575 1.919 0 N-CA-C 116.467 2.025 . . . . 0.0 116.467 174.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -136.15 -40.76 0.66 Allowed 'General case' 0 CA--C 1.573 1.845 0 C-N-CA 125.954 1.702 . . . . 0.0 113.08 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 74.2 m -84.64 152.22 23.95 Favored 'General case' 0 CA--C 1.567 1.605 0 N-CA-C 115.837 1.792 . . . . 0.0 115.837 -178.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -59.92 -55.88 28.65 Favored 'General case' 0 N--CA 1.503 2.209 0 C-N-CA 124.55 1.14 . . . . 0.0 109.896 173.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.6 m -82.27 102.1 10.96 Favored 'General case' 0 CA--C 1.569 1.686 0 N-CA-C 102.58 -3.119 . . . . 0.0 102.58 168.204 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -71.03 78.26 0.66 Allowed 'General case' 0 CA--C 1.569 1.697 0 CA-C-O 124.095 1.902 . . . . 0.0 114.583 -171.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 47.0 t -152.6 97.78 2.29 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-N 113.338 -1.756 . . . . 0.0 111.538 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 13.5 t -83.82 111.38 19.15 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 104.979 -2.23 . . . . 0.0 104.979 171.388 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.6 124.63 40.65 Favored 'General case' 0 CA--C 1.557 1.238 0 CA-C-O 122.472 1.129 . . . . 0.0 111.642 -172.713 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 -80.33 137.58 36.59 Favored 'General case' 0 CA--C 1.568 1.664 0 CA-C-O 122.698 1.237 . . . . 0.0 113.905 -174.122 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -63.98 -24.91 67.9 Favored 'General case' 0 CA--C 1.58 2.127 0 N-CA-C 117.5 2.407 . . . . 0.0 117.5 173.419 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.334 40.3 p 124.33 95.97 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 128.991 2.916 . . . . 0.0 108.496 174.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.414 7.5 tp 56.64 -49.11 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 N-CA-C 118.751 2.871 . . . . 0.0 118.751 177.669 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.6 tp -78.87 90.37 4.71 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 122.102 2.228 . . . . 0.0 108.522 173.464 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.3 p -52.51 103.95 0.08 Allowed 'General case' 0 CA--C 1.575 1.912 1 N-CA-C 122.514 4.265 . . . . 0.0 122.514 -171.247 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.0 tp -146.3 83.05 1.61 Allowed 'General case' 0 CA--C 1.572 1.799 0 N-CA-C 101.772 -3.418 . . . . 0.0 101.772 171.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.8 m -98.14 144.58 27.46 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -171.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.9 ttp180 -134.09 138.8 45.52 Favored 'General case' 0 CA--C 1.567 1.602 0 C-N-CA 124.372 1.069 . . . . 0.0 110.16 -175.696 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 65.1 m -68.04 144.87 54.92 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 119.694 -1.879 . . . . 0.0 114.017 177.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.75 172.81 12.18 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-N 113.416 -1.72 . . . . 0.0 114.381 -173.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 33.2 tp -81.71 143.79 31.6 Favored 'General case' 0 CA--C 1.567 1.626 0 CA-C-O 122.411 1.1 . . . . 0.0 113.196 -175.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.1 ptpt -66.2 145.53 55.68 Favored 'General case' 0 CA--C 1.574 1.874 0 CA-C-O 122.033 0.921 . . . . 0.0 113.271 174.23 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.13 159.75 29.53 Favored 'General case' 0 CA--C 1.569 1.682 0 N-CA-C 117.681 2.474 . . . . 0.0 117.681 -172.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.9 mtt180 -124.65 170.72 10.68 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 112.876 -1.966 . . . . 0.0 111.528 -177.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -45.34 125.87 5.93 Favored 'General case' 0 CA--C 1.571 1.78 0 N-CA-C 116.555 2.057 . . . . 0.0 116.555 -174.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 75.68 18.27 2.21 Favored 'General case' 0 N--CA 1.506 2.353 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -173.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.8 t -110.27 149.15 30.58 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 120.356 -1.465 . . . . 0.0 112.392 175.248 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -71.76 119.81 16.47 Favored 'General case' 0 CA--C 1.57 1.749 0 C-N-CA 124.799 1.24 . . . . 0.0 111.28 -179.382 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.436 ' SG ' ' HA ' ' A' ' 62' ' ' PRO . 0.6 OUTLIER -123.87 154.35 39.78 Favored 'General case' 0 CA--C 1.564 1.499 0 CA-C-O 123.305 1.526 . . . . 0.0 114.427 -174.621 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.3 t -93.65 109.55 21.18 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 171.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.0 10.13 3.11 Favored 'General case' 0 CA--C 1.582 2.203 0 N-CA-C 118.325 2.713 . . . . 0.0 118.325 -179.024 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 44.4 p90 -143.69 160.44 40.7 Favored 'General case' 0 CA--C 1.57 1.718 0 C-N-CA 126.47 1.908 . . . . 0.0 111.076 -173.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.7 p -131.2 136.52 48.34 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 122.675 1.226 . . . . 0.0 109.637 172.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -99.78 -136.74 0.3 Allowed 'General case' 0 CA--C 1.566 1.577 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 173.305 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -128.18 74.12 1.52 Allowed 'General case' 0 CA--C 1.568 1.667 0 N-CA-C 103.414 -2.81 . . . . 0.0 103.414 170.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 161.33 -146.2 11.94 Favored Glycine 0 N--CA 1.488 2.11 0 N-CA-C 117.294 1.678 . . . . 0.0 117.294 -175.014 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.0 t -91.35 147.18 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 CA-C-O 122.92 1.343 . . . . 0.0 112.52 -166.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -119.86 137.13 54.19 Favored 'General case' 0 CA--C 1.556 1.208 0 CA-C-O 122.349 1.071 . . . . 0.0 110.787 -174.416 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -76.08 -9.74 58.86 Favored 'General case' 0 CA--C 1.582 2.196 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 174.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 11.3 ptpt -163.91 125.01 2.26 Favored 'General case' 0 CA--C 1.567 1.608 0 N-CA-C 105.965 -1.865 . . . . 0.0 105.965 175.366 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 64.0 m -62.67 144.01 96.34 Favored Pre-proline 0 CA--C 1.589 2.474 0 N-CA-C 117.123 2.268 . . . . 0.0 117.123 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.436 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 77.5 Cg_exo -56.93 170.44 1.45 Allowed 'Trans proline' 0 CA--C 1.575 2.552 0 C-N-CA 123.067 2.511 . . . . 0.0 117.148 174.009 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 60.3 m -77.18 163.68 26.34 Favored 'General case' 0 CA--C 1.578 2.045 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -74.63 173.03 11.01 Favored 'General case' 0 CA--C 1.578 2.036 0 N-CA-C 117.351 2.352 . . . . 0.0 117.351 -175.412 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 53.1 tpt85 -66.94 113.47 4.99 Favored 'General case' 0 CA--C 1.571 1.756 0 O-C-N 120.524 -1.36 . . . . 0.0 111.6 174.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.63 -0.3 59.51 Favored Glycine 0 N--CA 1.499 2.841 0 N-CA-C 118.262 2.065 . . . . 0.0 118.262 -173.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.9 tt -135.79 132.81 37.2 Favored 'General case' 0 CA--C 1.568 1.671 0 CA-C-N 119.401 1.6 . . . . 0.0 107.742 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.32 159.85 14.73 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 116.445 2.017 . . . . 0.0 116.445 -171.728 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.9 t -93.11 127.62 38.72 Favored 'General case' 0 CA--C 1.57 1.747 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.653 173.247 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 . . . . . 0 N--CA 1.501 2.086 0 O-C-N 119.813 -1.804 . . . . 0.0 110.329 178.152 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 122.741 1.258 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -142.02 -171.21 12.9 Favored Glycine 0 N--CA 1.48 1.58 0 CA-C-N 115.351 -0.841 . . . . 0.0 115.194 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 32.3 mm -114.4 137.24 48.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 174.362 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 64.5 m -67.87 125.95 27.9 Favored 'General case' 0 CA--C 1.568 1.637 0 O-C-N 120.903 -1.123 . . . . 0.0 113.349 174.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -143.22 156.97 44.87 Favored 'General case' 0 CA--C 1.561 1.394 0 CA-C-O 123.43 1.585 . . . . 0.0 111.662 175.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -98.23 108.55 21.28 Favored 'General case' 0 CA--C 1.563 1.478 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 174.453 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.5 2.029 0 CA-C-O 123.579 1.656 . . . . 0.0 111.81 -174.684 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 . . . . . 0 CA--C 1.573 1.848 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 17.8 tp -96.68 96.68 8.79 Favored 'General case' 0 CA--C 1.568 1.636 0 O-C-N 120.15 -1.594 . . . . 0.0 113.442 174.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -98.24 151.68 20.21 Favored 'General case' 0 CA--C 1.578 2.026 0 N-CA-C 106.101 -1.814 . . . . 0.0 106.101 166.687 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -81.21 102.6 10.44 Favored 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 104.125 -2.546 . . . . 0.0 104.125 171.112 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 128.57 26.87 0.92 Allowed Glycine 0 CA--C 1.546 2.004 0 CA-C-N 113.547 -1.661 . . . . 0.0 115.669 -172.398 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -93.35 105.62 17.67 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 119.886 1.843 . . . . 0.0 108.167 172.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 mp -72.56 104.54 3.89 Favored 'General case' 0 N--CA 1.493 1.725 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 175.486 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 2.5 p -111.47 173.05 6.53 Favored 'General case' 0 CA--C 1.563 1.447 0 N-CA-C 117.888 2.551 . . . . 0.0 117.888 -171.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.1 tp -94.46 -73.71 0.57 Allowed 'General case' 0 CA--C 1.579 2.058 0 N-CA-C 105.965 -1.865 . . . . 0.0 105.965 170.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -100.7 -165.0 1.16 Allowed 'General case' 0 CA--C 1.583 2.249 0 C-N-CA 125.217 1.407 . . . . 0.0 113.707 172.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.1 m -93.61 -0.24 56.25 Favored 'General case' 0 N--CA 1.504 2.237 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 173.076 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.18 11.16 1.98 Allowed 'General case' 0 CA--C 1.578 2.037 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 174.221 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -96.2 -33.39 12.04 Favored 'General case' 0 CA--C 1.587 2.389 0 C-N-CA 125.766 1.627 . . . . 0.0 111.598 172.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . 0.305 85.0 m -87.6 131.33 34.45 Favored 'General case' 0 CA--C 1.587 2.388 0 C-N-CA 125.477 1.511 . . . . 0.0 109.674 172.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -41.33 -50.99 3.74 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 121.676 3.954 . . . . 0.0 121.676 -171.297 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 100.0 p -80.09 -77.33 0.19 Allowed 'General case' 0 CA--C 1.569 1.682 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 174.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -178.11 78.36 0.02 OUTLIER 'General case' 0 CA--C 1.571 1.752 0 N-CA-C 104.147 -2.538 . . . . 0.0 104.147 172.715 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 40.6 t -142.1 59.8 1.47 Allowed 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 116.203 1.927 . . . . 0.0 116.203 -173.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.525 ' HA ' ' SG ' ' A' ' 39' ' ' CYS . 19.3 t -92.84 119.53 32.27 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 169.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.91 115.73 31.1 Favored 'General case' 0 CA--C 1.569 1.703 0 CA-C-O 123.415 1.579 . . . . 0.0 113.745 -171.855 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.597 ' HB2' HG12 ' A' ' 57' ' ' VAL . 0.3 OUTLIER -87.91 118.04 27.18 Favored 'General case' 0 CA--C 1.565 1.55 0 C-N-CA 124.775 1.23 . . . . 0.0 111.201 -178.448 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -83.76 44.2 0.97 Allowed 'General case' 0 CA--C 1.584 2.255 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 176.254 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.412 0.7 OUTLIER 106.54 176.65 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.699 0 C-N-CA 128.842 2.857 . . . . 0.0 112.167 -174.808 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 28.1 mm -54.07 -67.54 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.527 0 O-C-N 119.532 -1.98 . . . . 0.0 115.296 -173.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 pp -97.68 49.97 1.04 Allowed 'General case' 0 N--CA 1.509 2.486 0 CA-C-N 120.517 1.508 . . . . 0.0 113.451 176.64 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.2 p -102.33 -3.52 27.02 Favored 'General case' 0 N--CA 1.492 1.663 1 N-CA-C 121.906 4.039 . . . . 0.0 121.906 -172.319 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 21.7 tp 70.6 120.16 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.174 0 CA-C-N 120.288 1.403 . . . . 0.0 109.566 -173.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.615 ' HB3' HG11 ' A' ' 57' ' ' VAL . 50.7 m -94.78 124.63 38.93 Favored 'General case' 0 CA--C 1.561 1.386 0 O-C-N 120.377 -1.452 . . . . 0.0 114.741 -172.322 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.3 ttt85 -132.1 134.21 45.2 Favored 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 124.43 1.092 . . . . 0.0 110.283 -175.003 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.525 ' SG ' ' HA ' ' A' ' 28' ' ' CYS . 89.3 m -70.35 151.04 45.68 Favored 'General case' 0 CA--C 1.56 1.355 0 O-C-N 119.511 -1.993 . . . . 0.0 114.224 177.265 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.29 -174.21 3.88 Favored 'General case' 0 CA--C 1.565 1.531 0 CA-C-N 113.031 -1.895 . . . . 0.0 113.374 -173.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.5 mt -79.58 149.4 31.39 Favored 'General case' 0 CA--C 1.57 1.737 0 CA-C-O 122.225 1.012 . . . . 0.0 112.191 175.022 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -69.35 153.25 43.89 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 175.081 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.07 151.51 40.15 Favored 'General case' 0 CA--C 1.57 1.743 0 CA-C-O 124.242 1.972 . . . . 0.0 113.941 -174.483 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -118.99 168.41 10.83 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-N 113.427 -1.715 . . . . 0.0 110.968 -175.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -53.1 120.9 6.47 Favored 'General case' 0 CA--C 1.571 1.774 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -173.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 79.48 25.53 0.42 Allowed 'General case' 0 N--CA 1.505 2.317 0 C-N-CA 125.439 1.496 . . . . 0.0 113.789 -172.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.7 t -126.61 154.1 44.42 Favored 'General case' 0 CA--C 1.567 1.618 0 O-C-N 120.378 -1.451 . . . . 0.0 110.492 174.473 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -64.59 130.84 45.19 Favored 'General case' 0 CA--C 1.574 1.883 0 N-CA-C 116.764 2.135 . . . . 0.0 116.764 -173.297 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.55 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 24.5 p -141.04 141.99 34.25 Favored 'General case' 0 CA--C 1.563 1.47 0 CA-C-N 113.112 -1.858 . . . . 0.0 113.099 177.732 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.5 t -87.01 134.39 33.49 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 170.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.43 -26.16 62.63 Favored 'General case' 0 CA--C 1.578 2.027 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 -177.454 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -127.46 157.37 40.24 Favored 'General case' 0 CA--C 1.572 1.801 0 C-N-CA 125.448 1.499 . . . . 0.0 107.897 172.005 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 17.6 p -129.24 160.46 32.88 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 124.146 1.927 . . . . 0.0 110.308 172.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.288 0.7 OUTLIER -96.49 -121.99 0.12 Allowed 'General case' 0 CA--C 1.575 1.917 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 174.347 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.37 3.15 2.56 Favored 'General case' 0 CA--C 1.589 2.452 0 O-C-N 119.62 -1.925 . . . . 0.0 112.622 171.406 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -99.85 -162.12 28.83 Favored Glycine 0 N--CA 1.481 1.675 0 O-C-N 120.557 -1.339 . . . . 0.0 113.403 -175.078 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.615 HG11 ' HB3' ' A' ' 37' ' ' SER . 4.9 t -79.41 137.42 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 CA-C-O 123.093 1.425 . . . . 0.0 109.86 -175.788 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -111.58 140.25 46.35 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -171.363 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -71.99 -1.73 15.62 Favored 'General case' 0 CA--C 1.587 2.389 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 174.269 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.3 123.62 0.97 Allowed 'General case' 0 CA--C 1.574 1.883 0 C-N-CA 127.879 2.472 . . . . 0.0 107.104 -174.329 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 36.2 m -70.73 129.07 90.27 Favored Pre-proline 0 CA--C 1.594 2.661 0 O-C-N 118.973 -2.33 . . . . 0.0 111.032 173.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -76.41 76.5 3.91 Favored 'Trans proline' 0 CA--C 1.573 2.427 0 N-CA-C 119.236 2.745 . . . . 0.0 119.236 -172.28 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 58.5 m 60.4 145.39 0.01 OUTLIER 'General case' 0 CA--C 1.578 2.041 0 N-CA-C 116.998 2.222 . . . . 0.0 116.998 174.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -65.78 162.01 19.65 Favored 'General case' 0 CA--C 1.578 2.038 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 174.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -63.02 109.28 1.43 Allowed 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.768 -1.207 . . . . 0.0 112.503 -177.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 112.92 -23.39 14.57 Favored Glycine 0 N--CA 1.498 2.812 0 N-CA-C 117.606 1.802 . . . . 0.0 117.606 -173.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.3 tp -99.1 143.22 29.62 Favored 'General case' 0 CA--C 1.572 1.79 0 CA-C-N 118.509 1.154 . . . . 0.0 111.625 -178.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -98.54 159.11 15.17 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.472 -1.393 . . . . 0.0 114.087 -174.565 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 10.4 t -93.8 123.7 37.31 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.687 172.291 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 . . . . . 0 N--CA 1.489 1.51 0 O-C-N 120.711 -1.243 . . . . 0.0 108.782 176.266 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 . . . . . 0 CA--C 1.571 1.786 0 CA-C-O 122.027 0.918 . . . . 0.0 112.883 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.65 -179.2 3.23 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 118.518 2.167 . . . . 0.0 118.518 178.398 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 39.3 mm -126.32 139.2 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.283 -1.128 . . . . 0.0 110.461 -174.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.55 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 59.7 m -69.11 128.35 36.33 Favored 'General case' 0 CA--C 1.57 1.717 0 O-C-N 120.291 -1.506 . . . . 0.0 114.464 174.546 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -141.7 158.99 43.13 Favored 'General case' 0 CA--C 1.565 1.547 0 CA-C-O 123.309 1.528 . . . . 0.0 111.922 175.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -97.65 128.14 44.13 Favored 'General case' 0 CA--C 1.562 1.433 0 CA-C-O 122.669 1.223 . . . . 0.0 111.385 178.199 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 12.3 p . . . . . 0 N--CA 1.493 1.718 0 CA-C-O 123.044 1.402 . . . . 0.0 109.093 177.418 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.3 0.5 OUTLIER . . . . . 0 N--CA 1.5 2.045 0 N-CA-C 116.952 2.204 . . . . 0.0 116.952 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.5 tp -129.77 126.21 37.62 Favored 'General case' 0 CA--C 1.574 1.895 0 C-N-CA 124.49 1.116 . . . . 0.0 108.934 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -80.31 167.34 20.38 Favored 'General case' 0 CA--C 1.573 1.862 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -174.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -63.72 138.15 58.37 Favored 'General case' 0 CA--C 1.572 1.815 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -176.44 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.81 -11.33 38.25 Favored Glycine 0 N--CA 1.496 2.653 0 N-CA-C 118.391 2.116 . . . . 0.0 118.391 -175.786 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 82.3 mm-40 -100.21 137.42 38.67 Favored 'General case' 0 CA--C 1.564 1.506 0 CA-C-N 118.99 1.395 . . . . 0.0 111.081 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 77.7 mt -67.45 134.3 51.14 Favored 'General case' 0 CA--C 1.573 1.853 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -174.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.5 p -122.97 177.84 5.32 Favored 'General case' 0 CA--C 1.573 1.849 0 CA-C-O 123.029 1.395 . . . . 0.0 113.408 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.9 mt -109.45 -74.41 0.66 Allowed 'General case' 0 CA--C 1.574 1.889 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 171.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.1 p30 -91.39 -173.23 3.53 Favored 'General case' 0 CA--C 1.581 2.154 0 C-N-CA 124.607 1.163 . . . . 0.0 113.181 172.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.8 t -94.4 -4.94 47.49 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 116.921 2.193 . . . . 0.0 116.921 174.127 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.44 1.87 15.24 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 117.382 2.364 . . . . 0.0 117.382 174.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -95.27 -20.92 18.78 Favored 'General case' 0 CA--C 1.57 1.717 0 N-CA-C 115.966 1.839 . . . . 0.0 115.966 -175.018 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.0 m -81.44 -131.72 0.03 OUTLIER 'General case' 0 CA--C 1.579 2.074 0 CA-C-N 121.236 1.834 . . . . 0.0 114.124 -175.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -72.73 -82.8 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.354 0 O-C-N 119.423 -2.048 . . . . 0.0 111.328 -177.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.6 p -88.79 -63.07 1.35 Allowed 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 121.966 0.889 . . . . 0.0 110.744 172.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -170.05 84.81 0.12 Allowed 'General case' 0 CA--C 1.569 1.706 0 N-CA-C 105.159 -2.163 . . . . 0.0 105.159 178.206 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.414 ' SG ' ' HB3' ' A' ' 40' ' ' ALA . 41.9 t -155.32 94.44 1.61 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 119.825 -1.797 . . . . 0.0 115.118 -176.724 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.513 ' HB3' HG13 ' A' ' 57' ' ' VAL . 9.8 t -114.81 139.39 49.77 Favored 'General case' 0 CA--C 1.56 1.364 0 CA-C-O 121.759 0.79 . . . . 0.0 108.988 171.708 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.46 124.61 29.06 Favored 'General case' 0 CA--C 1.573 1.837 0 CA-C-O 122.106 0.955 . . . . 0.0 109.124 174.367 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.71 ' HA ' ' CG1' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -27.45 4.93 0.0 OUTLIER 'General case' 0 CA--C 1.592 2.586 3 N-CA-C 142.845 11.794 . . . . 0.0 142.845 -166.852 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . 0.261 1.3 p30 -24.65 72.49 0.0 OUTLIER 'General case' 0 N--CA 1.531 3.592 2 CA-C-N 131.633 6.56 . . . . 0.0 125.005 -167.732 . . . . . . . . 3 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.4 t -139.85 14.74 2.49 Favored 'General case' 0 CA--C 1.583 2.235 0 CA-C-N 114.05 -1.432 . . . . 0.0 113.957 173.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.0 pt -140.12 -59.04 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 CA-C-N 120.054 1.297 . . . . 0.0 111.535 174.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 93.8 mt -131.86 -68.22 0.65 Allowed 'General case' 0 N--CA 1.498 1.936 0 CA-C-N 120.513 1.506 . . . . 0.0 113.171 -174.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.7 p -90.01 163.95 14.71 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 -174.369 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.6 tp -66.98 163.02 20.71 Favored 'General case' 0 CA--C 1.584 2.282 0 O-C-N 121.517 -0.739 . . . . 0.0 111.9 173.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.1 m -91.96 127.62 37.5 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 119.885 -1.759 . . . . 0.0 111.732 -172.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -111.66 154.51 24.82 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.86 174.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 55.7 m -63.57 151.5 41.35 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 118.751 -2.468 . . . . 0.0 112.099 174.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.414 ' HB3' ' SG ' ' A' ' 27' ' ' CYS 0.275 . . -133.82 -172.64 3.03 Favored 'General case' 0 CA--C 1.567 1.612 0 CA-C-N 113.123 -1.853 . . . . 0.0 110.663 -175.88 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 94.4 mt -125.0 150.42 46.72 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.856 -1.152 . . . . 0.0 112.008 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -63.9 144.03 57.39 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.383 -0.823 . . . . 0.0 111.456 173.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.96 147.03 35.13 Favored 'General case' 0 CA--C 1.566 1.586 0 CA-C-O 124.678 2.18 . . . . 0.0 116.246 -173.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -101.56 170.27 8.3 Favored 'General case' 0 CA--C 1.56 1.336 0 CA-C-N 111.449 -2.614 . . . . 0.0 111.161 -178.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -59.26 124.26 19.4 Favored 'General case' 0 CA--C 1.57 1.741 0 O-C-N 120.84 -1.162 . . . . 0.0 112.851 -175.623 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 83.21 22.01 0.17 Allowed 'General case' 0 N--CA 1.506 2.359 0 C-N-CA 125.602 1.561 . . . . 0.0 113.859 -172.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.4 t -121.28 150.1 41.91 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.059 -1.651 . . . . 0.0 111.657 174.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -69.08 141.7 54.66 Favored 'General case' 0 CA--C 1.57 1.713 0 CA-C-O 123.305 1.526 . . . . 0.0 113.391 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 8.5 p -140.33 148.81 41.91 Favored 'General case' 0 CA--C 1.564 1.514 0 CA-C-N 113.127 -1.851 . . . . 0.0 113.387 -175.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.5 p -77.26 110.51 12.03 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 120.878 -1.138 . . . . 0.0 108.421 173.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -76.3 20.23 0.22 Allowed 'General case' 0 CA--C 1.576 1.963 0 N-CA-C 120.46 3.504 . . . . 0.0 120.46 -172.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -158.1 -56.47 0.07 Allowed 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 124.869 1.268 . . . . 0.0 113.348 -174.358 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.8 p 72.29 147.12 0.08 Allowed 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 127.607 2.363 . . . . 0.0 113.702 -174.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -100.06 -139.24 0.32 Allowed 'General case' 0 CA--C 1.576 1.956 0 CA-C-N 113.143 -1.844 . . . . 0.0 107.04 172.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -136.78 68.82 1.42 Allowed 'General case' 0 CA--C 1.567 1.625 0 CA-C-O 123.796 1.76 . . . . 0.0 107.921 169.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -177.66 -156.96 17.52 Favored Glycine 0 CA--C 1.544 1.858 0 CA-C-N 113.781 -1.554 . . . . 0.0 111.522 -176.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.71 ' CG1' ' HA ' ' A' ' 30' ' ' HIS . 1.2 t -75.17 154.47 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.213 0 O-C-N 121.283 -1.127 . . . . 0.0 112.928 -171.003 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -123.11 139.1 54.41 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 116.581 2.067 . . . . 0.0 116.581 -171.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -68.71 -38.88 80.59 Favored 'General case' 0 N--CA 1.502 2.128 0 N-CA-C 113.853 1.056 . . . . 0.0 113.853 172.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -143.01 109.14 5.24 Favored 'General case' 0 CA--C 1.563 1.479 0 N-CA-C 104.381 -2.451 . . . . 0.0 104.381 174.236 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 49.2 m -52.23 150.81 7.88 Favored Pre-proline 0 CA--C 1.588 2.415 0 N-CA-C 116.085 1.883 . . . . 0.0 116.085 178.719 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -63.25 166.28 15.21 Favored 'Trans proline' 0 CA--C 1.572 2.385 0 C-N-CA 122.308 2.005 . . . . 0.0 115.924 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 80.3 m -69.2 150.73 47.16 Favored 'General case' 0 CA--C 1.572 1.805 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 178.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -71.24 163.47 27.58 Favored 'General case' 0 CA--C 1.573 1.857 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 174.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -54.55 118.55 4.26 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 -174.243 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.04 -29.49 9.66 Favored Glycine 0 CA--C 1.556 2.648 0 CA-C-N 114.153 -1.385 . . . . 0.0 115.851 -172.371 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.9 mp -99.57 144.11 29.05 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-O 122.77 1.271 . . . . 0.0 112.115 -177.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -112.16 159.14 18.84 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 124.16 0.984 . . . . 0.0 112.607 -177.079 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 3.0 t -88.83 80.79 7.08 Favored 'General case' 0 CA--C 1.575 1.926 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 177.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 . . . . . 0 CA--C 1.569 1.675 0 O-C-N 120.932 -1.105 . . . . 0.0 113.307 -174.557 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 . . . . . 0 N--CA 1.498 1.928 0 CA-C-O 122.495 1.14 . . . . 0.0 111.977 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -78.74 163.92 50.1 Favored Glycine 0 N--CA 1.489 2.205 0 CA-C-N 115.762 -0.654 . . . . 0.0 114.595 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 35.2 mm -103.63 132.57 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 69.6 m -62.14 119.75 9.56 Favored 'General case' 0 CA--C 1.564 1.502 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 176.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -143.99 154.1 42.93 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-O 122.324 1.059 . . . . 0.0 110.82 175.336 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -92.89 87.51 5.83 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 123.761 1.744 . . . . 0.0 110.374 -174.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.4 t . . . . . 0 N--CA 1.493 1.679 0 CA-C-N 113.165 -1.834 . . . . 0.0 107.001 -174.765 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 71.7 m-80 . . . . . 0 CA--C 1.582 2.205 0 N-CA-C 118.015 2.598 . . . . 0.0 118.015 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 48.6 tp -103.27 142.82 33.54 Favored 'General case' 0 CA--C 1.58 2.107 0 O-C-N 119.734 -1.854 . . . . 0.0 109.178 173.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.86 179.68 7.7 Favored 'General case' 0 CA--C 1.572 1.798 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -174.589 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -74.4 168.47 19.63 Favored 'General case' 0 CA--C 1.575 1.916 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.97 13.63 74.28 Favored Glycine 0 CA--C 1.561 2.929 0 N-CA-C 117.13 1.612 . . . . 0.0 117.13 -172.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -117.91 143.27 46.48 Favored 'General case' 0 CA--C 1.567 1.609 0 C-N-CA 125.21 1.404 . . . . 0.0 110.504 -173.124 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.3 tt -71.94 131.11 42.5 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.872 -1.143 . . . . 0.0 111.271 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.54 ' SG ' ' O ' ' A' ' 19' ' ' ASN . 0.4 OUTLIER -135.96 154.25 51.16 Favored 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -173.751 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.5 mt -100.72 -67.56 0.85 Allowed 'General case' 0 CA--C 1.576 1.969 0 CA-C-N 113.622 -1.626 . . . . 0.0 108.983 171.519 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.54 ' O ' ' SG ' ' A' ' 17' ' ' CYS . 62.1 m-20 -108.18 -171.58 1.89 Allowed 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 120.776 1.625 . . . . 0.0 114.894 173.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.7 m -64.61 -30.69 71.71 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 118.92 -2.363 . . . . 0.0 113.769 172.66 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.31 43.34 1.01 Allowed 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 116.112 1.893 . . . . 0.0 116.112 173.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -117.7 -71.12 0.75 Allowed 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 102.281 -3.229 . . . . 0.0 102.281 171.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 34.7 m -84.89 81.04 9.06 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 103.437 -2.801 . . . . 0.0 103.437 167.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.7 mttm -66.76 5.92 0.56 Allowed 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 120.164 3.394 . . . . 0.0 120.164 -169.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.6 p -73.22 -72.93 0.23 Allowed 'General case' 0 CA--C 1.572 1.792 0 CA-C-O 118.613 -0.708 . . . . 0.0 109.14 171.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -166.68 14.44 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 115.981 1.845 . . . . 0.0 115.981 174.353 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 42.7 t -153.83 94.3 1.75 Allowed 'General case' 0 N--CA 1.499 2.019 0 CA-C-N 123.874 3.034 . . . . 0.0 117.973 -171.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.453 ' SG ' HG22 ' A' ' 57' ' ' VAL . 50.8 t -94.65 105.21 17.15 Favored 'General case' 0 CA--C 1.563 1.447 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 170.093 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.54 130.95 45.11 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 123.141 1.448 . . . . 0.0 112.824 -173.012 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 35.5 t60 -81.9 159.48 23.65 Favored 'General case' 0 CA--C 1.564 1.505 0 CA-C-O 122.815 1.293 . . . . 0.0 114.145 -174.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.3 p-10 -79.92 -51.42 9.12 Favored 'General case' 0 CA--C 1.57 1.717 0 CA-C-O 118.47 -0.776 . . . . 0.0 112.287 173.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -177.95 -65.37 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 124.589 1.156 . . . . 0.0 110.693 173.385 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 38.2 mm -133.01 -61.37 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 CA-C-N 121.042 1.746 . . . . 0.0 109.578 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.0 tp -71.06 102.4 2.45 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 120.192 1.36 . . . . 0.0 110.519 176.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 60.5 p -53.34 92.12 0.01 OUTLIER 'General case' 0 CA--C 1.573 1.856 1 N-CA-C 122.168 4.136 . . . . 0.0 122.168 -171.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 tt -125.5 87.03 2.63 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 101.865 -3.383 . . . . 0.0 101.865 171.011 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.7 m -99.98 136.39 39.96 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 -171.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -121.76 141.58 51.05 Favored 'General case' 0 CA--C 1.565 1.557 0 CA-C-N 114.707 -1.133 . . . . 0.0 108.347 174.523 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.7 m -79.55 146.31 32.69 Favored 'General case' 0 CA--C 1.556 1.174 0 O-C-N 119.492 -2.005 . . . . 0.0 113.831 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -135.64 -178.21 5.02 Favored 'General case' 0 CA--C 1.566 1.572 0 CA-C-N 113.841 -1.527 . . . . 0.0 113.996 -173.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.48 135.45 33.34 Favored 'General case' 0 CA--C 1.571 1.77 0 O-C-N 121.252 -0.905 . . . . 0.0 110.177 176.104 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.43 160.36 27.61 Favored 'General case' 0 CA--C 1.579 2.06 0 O-C-N 120.908 -1.12 . . . . 0.0 113.236 176.602 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.41 155.25 36.56 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 117.069 2.248 . . . . 0.0 117.069 -173.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 -117.18 175.77 5.45 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-N 112.889 -1.959 . . . . 0.0 110.696 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -58.38 128.1 35.45 Favored 'General case' 0 CA--C 1.57 1.748 0 O-C-N 120.651 -1.28 . . . . 0.0 113.631 -174.243 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 82.5 11.06 0.61 Allowed 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 125.748 1.619 . . . . 0.0 114.217 -173.007 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.7 t -110.36 147.16 34.5 Favored 'General case' 0 CA--C 1.563 1.458 0 O-C-N 120.143 -1.598 . . . . 0.0 111.988 175.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -80.11 110.56 15.63 Favored 'General case' 0 CA--C 1.57 1.734 0 CA-C-O 123.114 1.435 . . . . 0.0 112.449 -177.085 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.2 152.29 20.06 Favored 'General case' 0 CA--C 1.563 1.456 0 C-N-CA 125.926 1.69 . . . . 0.0 112.464 174.713 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.5 t -79.46 103.08 9.13 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 171.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.96 -38.51 69.76 Favored 'General case' 0 CA--C 1.566 1.562 0 N-CA-C 118.413 2.745 . . . . 0.0 118.413 -171.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.4 p90 -80.94 61.38 4.52 Favored 'General case' 0 CA--C 1.571 1.779 0 C-N-CA 124.728 1.211 . . . . 0.0 113.132 175.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.9 p -68.95 135.26 50.69 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 119.005 -2.309 . . . . 0.0 112.581 -174.373 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.307 0.5 OUTLIER -94.87 -135.32 0.2 Allowed 'General case' 0 CA--C 1.565 1.556 0 CA-C-N 111.551 -2.568 . . . . 0.0 107.272 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -139.45 73.57 1.44 Allowed 'General case' 0 CA--C 1.561 1.38 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 169.302 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -172.98 -140.6 3.2 Favored Glycine 0 N--CA 1.482 1.756 0 CA-C-N 115.3 -0.864 . . . . 0.0 113.333 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.453 HG22 ' SG ' ' A' ' 28' ' ' CYS . 3.4 t -87.56 142.98 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 CA-C-O 122.89 1.329 . . . . 0.0 111.139 -178.223 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -117.85 132.66 56.41 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-O 122.515 1.15 . . . . 0.0 110.353 -174.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -62.21 -43.68 98.28 Favored 'General case' 0 CA--C 1.581 2.148 0 CA-C-N 115.604 -0.725 . . . . 0.0 112.913 174.306 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -137.1 110.91 8.15 Favored 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 103.46 -2.793 . . . . 0.0 103.46 172.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 51.3 m -51.4 152.68 4.26 Favored Pre-proline 0 CA--C 1.593 2.605 0 N-CA-C 116.911 2.189 . . . . 0.0 116.911 -176.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.62 -173.8 0.4 Allowed 'Trans proline' 0 CA--C 1.572 2.407 0 C-N-CA 122.851 2.368 . . . . 0.0 116.619 -174.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 70.2 m -80.08 155.62 27.45 Favored 'General case' 0 CA--C 1.573 1.834 0 O-C-N 120.427 -1.42 . . . . 0.0 113.56 -178.393 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.86 -178.8 2.0 Favored 'General case' 0 CA--C 1.578 2.055 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 -175.394 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.95 112.46 3.31 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.364 -1.46 . . . . 0.0 112.562 -175.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 86.55 29.26 24.77 Favored Glycine 0 CA--C 1.556 2.637 0 N-CA-C 117.435 1.734 . . . . 0.0 117.435 -173.345 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.9 tp -141.11 141.35 34.21 Favored 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 118.812 1.306 . . . . 0.0 111.083 -176.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.74 158.32 16.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.674 -1.266 . . . . 0.0 113.219 -176.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 4.3 t -91.09 95.35 10.04 Favored 'General case' 0 CA--C 1.575 1.933 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 173.014 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 . . . . . 0 N--CA 1.498 1.943 0 N-CA-C 118.561 2.8 . . . . 0.0 118.561 -171.074 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 . . . . . 0 N--CA 1.495 1.786 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -125.01 160.46 19.63 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 118.184 2.034 . . . . 0.0 118.184 -177.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.5 mm -91.96 129.57 42.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 O-C-N 120.989 -1.301 . . . . 0.0 109.675 -172.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.6 m -64.04 124.52 21.81 Favored 'General case' 0 CA--C 1.567 1.618 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 177.499 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 72.8 m-70 -143.8 161.37 38.8 Favored 'General case' 0 CA--C 1.565 1.55 0 CA-C-O 123.462 1.601 . . . . 0.0 111.988 175.233 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -98.08 131.47 44.45 Favored 'General case' 0 CA--C 1.563 1.448 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.145 175.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.7 t . . . . . 0 N--CA 1.5 2.039 0 CA-C-O 123.068 1.413 . . . . 0.0 108.566 -179.194 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.25 62.5 m-80 . . . . . 0 N--CA 1.502 2.149 0 CA-C-O 121.61 0.719 . . . . 0.0 110.297 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -139.98 158.15 44.53 Favored 'General case' 0 CA--C 1.573 1.841 0 CA-C-O 122.771 1.272 . . . . 0.0 110.987 173.781 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -79.69 162.13 25.39 Favored 'General case' 0 CA--C 1.566 1.588 0 N-CA-C 115.237 1.569 . . . . 0.0 115.237 -173.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -78.18 126.51 30.91 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-O 122.403 1.097 . . . . 0.0 109.741 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 114.91 19.09 6.12 Favored Glycine 0 CA--C 1.559 2.79 0 N-CA-C 116.019 1.168 . . . . 0.0 116.019 -172.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -135.08 149.97 50.16 Favored 'General case' 0 CA--C 1.569 1.693 0 CA-C-N 119.215 1.507 . . . . 0.0 111.181 -178.347 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mp -73.48 147.21 44.31 Favored 'General case' 0 CA--C 1.575 1.926 0 N-CA-C 114.093 1.146 . . . . 0.0 114.093 -178.368 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 4.0 p -135.73 -175.08 3.84 Favored 'General case' 0 CA--C 1.574 1.901 0 CA-C-O 122.767 1.27 . . . . 0.0 114.234 -174.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.5 mt -109.31 -76.96 0.6 Allowed 'General case' 0 CA--C 1.575 1.921 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 170.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.2 p30 -96.1 -178.43 4.33 Favored 'General case' 0 CA--C 1.584 2.267 0 N-CA-C 114.908 1.448 . . . . 0.0 114.908 172.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 t -85.42 -17.54 36.3 Favored 'General case' 0 N--CA 1.503 2.206 0 N-CA-C 117.358 2.355 . . . . 0.0 117.358 174.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.14 9.75 2.35 Favored 'General case' 0 CA--C 1.577 1.998 0 N-CA-C 116.771 2.138 . . . . 0.0 116.771 174.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -97.0 -31.44 12.52 Favored 'General case' 0 CA--C 1.567 1.611 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.7 m -68.7 170.48 9.31 Favored 'General case' 0 CA--C 1.581 2.171 0 CA-C-N 121.232 1.833 . . . . 0.0 113.586 174.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -65.85 -65.25 0.7 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.034 -1.666 . . . . 0.0 108.751 172.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 83.4 p -83.65 107.49 16.13 Favored 'General case' 0 CA--C 1.566 1.588 0 N-CA-C 102.866 -3.013 . . . . 0.0 102.866 168.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -66.15 79.29 0.09 Allowed 'General case' 0 N--CA 1.501 2.089 0 CA-C-O 124.746 2.212 . . . . 0.0 115.596 -171.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 36.4 t -143.19 89.77 2.13 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 112.083 -2.326 . . . . 0.0 111.22 174.302 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.2 t -86.78 114.57 23.56 Favored 'General case' 0 CA--C 1.555 1.163 0 N-CA-C 102.688 -3.079 . . . . 0.0 102.688 169.227 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -96.97 123.65 40.74 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-O 123.525 1.631 . . . . 0.0 112.34 -171.474 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.449 ' HB2' HG12 ' A' ' 57' ' ' VAL . 13.5 t60 -83.18 141.85 31.62 Favored 'General case' 0 CA--C 1.558 1.286 0 CA-C-N 114.079 -1.419 . . . . 0.0 113.865 -174.585 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -68.51 17.26 0.04 OUTLIER 'General case' 0 CA--C 1.586 2.353 0 N-CA-C 117.46 2.393 . . . . 0.0 117.46 172.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.263 42.8 p 65.54 65.99 0.54 Allowed 'General case' 0 N--CA 1.499 2.023 0 C-N-CA 126.103 1.761 . . . . 0.0 112.866 -177.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.336 13.4 mt 78.62 151.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.511 2.597 0 C-N-CA 125.188 1.395 . . . . 0.0 110.256 -179.1 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.8 tp 66.46 75.4 0.33 Allowed 'General case' 0 N--CA 1.51 2.571 0 O-C-N 120.197 -1.564 . . . . 0.0 108.587 -172.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.0 p -48.11 100.56 0.02 OUTLIER 'General case' 0 CA--C 1.574 1.885 1 N-CA-C 123.457 4.614 . . . . 0.0 123.457 -170.761 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 30.6 tp -132.42 82.79 2.03 Favored 'General case' 0 CA--C 1.572 1.79 0 N-CA-C 101.645 -3.465 . . . . 0.0 101.645 170.459 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.0 m -99.85 131.72 45.65 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 -171.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -135.48 136.12 41.02 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 123.976 0.91 . . . . 0.0 110.981 -174.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 60.6 m -63.25 136.64 57.83 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 119.873 -1.767 . . . . 0.0 112.985 176.047 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.86 179.78 6.66 Favored 'General case' 0 CA--C 1.565 1.533 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -173.336 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -76.45 164.44 25.98 Favored 'General case' 0 CA--C 1.571 1.759 0 CA-C-O 122.417 1.103 . . . . 0.0 113.962 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.91 163.14 28.59 Favored 'General case' 0 CA--C 1.567 1.612 0 N-CA-C 115.078 1.51 . . . . 0.0 115.078 179.039 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.4 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . . . -81.03 142.84 32.98 Favored 'General case' 0 CA--C 1.564 1.489 0 CA-C-O 123.822 1.772 . . . . 0.0 113.434 177.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -96.65 164.14 12.71 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-N 113.739 -1.573 . . . . 0.0 112.173 -174.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -53.98 123.97 14.14 Favored 'General case' 0 CA--C 1.571 1.772 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -174.339 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 84.6 18.77 0.15 Allowed 'General case' 0 N--CA 1.508 2.444 0 C-N-CA 126.056 1.742 . . . . 0.0 113.949 -172.685 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.9 t -119.95 150.82 39.89 Favored 'General case' 0 CA--C 1.566 1.591 0 O-C-N 120.203 -1.56 . . . . 0.0 112.211 174.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -67.13 141.14 57.51 Favored 'General case' 0 CA--C 1.57 1.738 0 CA-C-O 122.886 1.327 . . . . 0.0 114.315 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -129.44 139.09 51.74 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-N 113.861 -1.518 . . . . 0.0 112.811 -176.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.8 t -87.82 85.56 7.05 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-O 122.171 0.986 . . . . 0.0 109.981 174.132 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.48 -33.05 64.63 Favored 'General case' 0 CA--C 1.571 1.752 0 N-CA-C 119.479 3.14 . . . . 0.0 119.479 -173.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -78.8 153.93 30.31 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 125.502 1.521 . . . . 0.0 112.915 174.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.1 p -112.44 125.4 54.17 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 123.338 1.542 . . . . 0.0 109.8 172.092 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.513 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.7 pt? -99.64 -159.41 0.74 Allowed 'General case' 0 CA--C 1.576 1.972 0 CA-C-N 112.655 -2.066 . . . . 0.0 106.738 171.079 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -112.49 64.42 0.63 Allowed 'General case' 0 N--CA 1.5 2.049 0 O-C-N 119.634 -1.916 . . . . 0.0 106.109 171.67 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 178.89 -165.83 35.1 Favored Glycine 0 CA--C 1.542 1.757 0 CA-C-N 113.724 -1.58 . . . . 0.0 114.872 -173.198 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.449 HG12 ' HB2' ' A' ' 30' ' ' HIS . 44.4 t -92.87 156.23 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 CA-C-O 123.314 1.531 . . . . 0.0 113.171 -166.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 17.6 m-30 -106.44 140.76 38.84 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 114.797 -1.092 . . . . 0.0 113.742 -176.105 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -71.58 -59.16 2.9 Favored 'General case' 0 CA--C 1.575 1.911 0 O-C-N 121.23 -0.919 . . . . 0.0 113.051 175.528 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.96 119.62 30.95 Favored 'General case' 0 CA--C 1.567 1.621 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 174.915 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 55.1 m -49.46 153.34 1.92 Allowed Pre-proline 0 CA--C 1.588 2.432 0 N-CA-C 120.064 3.357 . . . . 0.0 120.064 -177.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -58.23 169.47 2.9 Favored 'Trans proline' 0 CA--C 1.573 2.453 0 C-N-CA 123.216 2.611 . . . . 0.0 115.573 172.588 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 2.7 m -94.02 107.16 19.1 Favored 'General case' 0 CA--C 1.577 1.985 0 O-C-N 120.397 -1.439 . . . . 0.0 109.19 175.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.401 0.0 OUTLIER -83.86 -63.16 1.4 Allowed 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 120.961 3.689 . . . . 0.0 120.961 -171.32 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.89 82.11 7.65 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.245 -1.535 . . . . 0.0 114.957 -173.229 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 71.24 33.26 64.85 Favored Glycine 0 N--CA 1.495 2.616 0 N-CA-C 119.339 2.495 . . . . 0.0 119.339 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.4 mp -122.33 143.98 49.29 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 122.51 1.147 . . . . 0.0 111.464 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.63 155.82 17.86 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 122.227 1.013 . . . . 0.0 112.55 177.325 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 3.5 t -94.88 86.99 4.83 Favored 'General case' 0 CA--C 1.575 1.941 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.421 175.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 . . . . . 0 N--CA 1.492 1.668 0 O-C-N 120.514 -1.366 . . . . 0.0 112.98 -173.556 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 . . . . . 0 CA--C 1.57 1.745 0 CA-C-O 121.913 0.864 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -89.95 155.24 24.42 Favored Glycine 0 N--CA 1.499 2.867 0 O-C-N 120.922 -1.111 . . . . 0.0 114.614 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 29.5 mm -94.45 130.83 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 120.232 -1.746 . . . . 0.0 110.931 -170.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.4 ' SG ' ' HB3' ' A' ' 43' ' ' ALA . 95.8 m -61.11 120.53 10.48 Favored 'General case' 0 CA--C 1.566 1.576 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 175.109 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -144.52 143.54 30.9 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 122.481 1.134 . . . . 0.0 110.617 174.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -95.67 77.32 3.28 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 124.279 1.99 . . . . 0.0 111.792 -174.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.9 m . . . . . 0 CA--C 1.577 1.991 0 N-CA-C 117.161 2.282 . . . . 0.0 117.161 -177.714 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 . . . . . 0 N--CA 1.494 1.758 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.2 tp -154.05 118.63 4.91 Favored 'General case' 0 CA--C 1.574 1.895 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 175.105 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -74.04 164.82 26.14 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -173.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 mp0 -69.86 132.84 46.64 Favored 'General case' 0 CA--C 1.567 1.604 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.891 -174.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.04 -10.29 51.46 Favored Glycine 0 N--CA 1.497 2.703 0 N-CA-C 117.18 1.632 . . . . 0.0 117.18 -173.406 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -99.23 144.11 28.73 Favored 'General case' 0 CA--C 1.566 1.569 0 CA-C-N 118.983 1.392 . . . . 0.0 110.843 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.5 mp -67.29 136.21 54.53 Favored 'General case' 0 CA--C 1.575 1.915 0 N-CA-C 113.904 1.075 . . . . 0.0 113.904 -175.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 11.7 p -137.92 144.57 41.34 Favored 'General case' 0 CA--C 1.565 1.522 0 C-N-CA 124.034 0.934 . . . . 0.0 112.122 -177.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 78.1 mt -82.99 -66.1 0.93 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.253 -0.904 . . . . 0.0 112.155 176.177 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -98.76 165.33 11.84 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 120.002 1.274 . . . . 0.0 113.198 174.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -74.92 -13.4 60.53 Favored 'General case' 0 N--CA 1.506 2.371 0 N-CA-C 116.301 1.963 . . . . 0.0 116.301 172.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.55 30.79 0.41 Allowed 'General case' 0 CA--C 1.58 2.098 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 172.145 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -127.95 -23.76 3.3 Favored 'General case' 0 CA--C 1.571 1.751 0 CA-C-O 116.767 -1.587 . . . . 0.0 114.863 -175.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 57.0 m -73.31 -144.99 0.02 OUTLIER 'General case' 0 CA--C 1.587 2.402 0 CA-C-N 122.23 2.287 . . . . 0.0 113.254 176.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -83.57 -67.64 0.77 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 118.759 -2.463 . . . . 0.0 114.233 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 61.9 p -84.66 -74.21 0.4 Allowed 'General case' 0 CA--C 1.566 1.584 0 O-C-N 121.248 -0.908 . . . . 0.0 111.235 174.719 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.5 t-20 -172.76 77.8 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 C-N-CA 124.731 1.212 . . . . 0.0 109.521 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.8 t -160.29 98.04 1.26 Allowed 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 121.259 1.845 . . . . 0.0 115.798 173.163 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.8 t -101.11 117.43 34.99 Favored 'General case' 0 CA--C 1.562 1.405 0 N-CA-C 103.046 -2.946 . . . . 0.0 103.046 169.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 65.1 tp60 -94.94 113.09 24.76 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.363 1.065 . . . . 0.0 113.739 -173.169 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.534 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.1 t60 -81.85 135.01 35.46 Favored 'General case' 0 CA--C 1.56 1.361 0 CA-C-N 114.741 -1.118 . . . . 0.0 111.119 176.39 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.4 p-10 -73.09 -75.53 0.14 Allowed 'General case' 0 CA--C 1.574 1.885 0 CA-C-O 118.326 -0.845 . . . . 0.0 113.043 174.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.5 t -169.5 92.6 0.25 Allowed 'General case' 0 N--CA 1.502 2.142 0 CA-C-N 120.906 1.685 . . . . 0.0 111.51 -177.05 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.305 3.8 mp 70.65 -69.06 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 C-N-CA 125.427 1.491 . . . . 0.0 111.348 174.779 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.4 mp -69.08 109.56 4.07 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 120.304 1.411 . . . . 0.0 107.697 173.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 56.7 p -72.2 83.57 1.02 Allowed 'General case' 0 CA--C 1.567 1.617 0 N-CA-C 120.502 3.519 . . . . 0.0 120.502 -171.371 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.7 tp -104.99 81.13 1.7 Allowed 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 103.305 -2.85 . . . . 0.0 103.305 170.011 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 26.9 m -100.58 124.17 45.79 Favored 'General case' 0 CA--C 1.564 1.495 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -170.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 65.6 mtt85 -114.33 167.85 10.35 Favored 'General case' 0 N--CA 1.501 2.102 0 C-N-CA 124.05 0.94 . . . . 0.0 111.601 174.619 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 83.4 m -79.95 147.86 31.44 Favored 'General case' 0 CA--C 1.568 1.649 0 O-C-N 118.565 -2.584 . . . . 0.0 111.104 172.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.91 172.43 12.7 Favored 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 -174.451 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.1 mt -85.25 152.67 23.14 Favored 'General case' 0 CA--C 1.568 1.663 0 CA-C-O 122.2 1.0 . . . . 0.0 113.034 -178.586 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -64.88 146.31 55.08 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 178.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.91 155.11 33.05 Favored 'General case' 0 CA--C 1.564 1.504 0 CA-C-O 123.398 1.571 . . . . 0.0 114.848 -175.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -108.33 172.66 6.71 Favored 'General case' 0 CA--C 1.562 1.422 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.448 -174.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -52.7 126.72 20.78 Favored 'General case' 0 CA--C 1.572 1.814 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 -174.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 74.51 20.11 2.55 Favored 'General case' 0 N--CA 1.506 2.347 0 N-CA-C 114.858 1.429 . . . . 0.0 114.858 -173.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 37.3 t -115.41 153.37 31.18 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 120.524 -1.36 . . . . 0.0 111.188 174.514 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -64.46 136.92 57.55 Favored 'General case' 0 CA--C 1.57 1.722 0 CA-C-O 123.18 1.467 . . . . 0.0 113.017 176.085 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.463 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 17.0 p -138.19 139.96 39.56 Favored 'General case' 0 CA--C 1.559 1.312 0 CA-C-N 113.194 -1.821 . . . . 0.0 112.436 -176.026 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.1 t -75.14 90.39 2.53 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 122.991 1.377 . . . . 0.0 110.704 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.565 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . . . -76.56 -51.04 12.41 Favored 'General case' 0 CA--C 1.568 1.65 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 -173.485 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 54.0 p90 -79.25 -37.26 38.38 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 117.193 2.294 . . . . 0.0 117.193 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 80.4 p 62.84 144.04 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 127.034 2.134 . . . . 0.0 114.644 -174.366 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.23 -168.36 1.55 Allowed 'General case' 0 CA--C 1.567 1.632 0 CA-C-N 113.934 -1.485 . . . . 0.0 108.436 171.505 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -103.42 74.3 1.26 Allowed 'General case' 0 CA--C 1.567 1.62 0 N-CA-C 105.191 -2.152 . . . . 0.0 105.191 171.049 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 166.42 -160.18 33.68 Favored Glycine 0 N--CA 1.482 1.701 0 CA-C-O 122.388 0.993 . . . . 0.0 115.079 -174.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.534 HG12 ' HB2' ' A' ' 30' ' ' HIS . 13.3 t -83.91 143.98 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 CA-C-O 122.935 1.35 . . . . 0.0 112.32 -167.592 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -109.24 135.18 50.76 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.916 -174.087 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -74.51 -17.58 60.73 Favored 'General case' 0 CA--C 1.589 2.447 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 173.361 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm -147.67 119.21 7.94 Favored 'General case' 0 CA--C 1.572 1.817 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 174.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 74.4 m -55.51 151.11 21.79 Favored Pre-proline 0 CA--C 1.586 2.357 0 N-CA-C 117.366 2.358 . . . . 0.0 117.366 177.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -66.79 172.88 8.89 Favored 'Trans proline' 0 CA--C 1.576 2.61 0 C-N-CA 122.464 2.109 . . . . 0.0 115.623 174.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 34.1 m -74.7 154.67 38.34 Favored 'General case' 0 CA--C 1.579 2.065 0 O-C-N 120.63 -1.294 . . . . 0.0 114.481 -178.223 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.41 179.15 7.85 Favored 'General case' 0 CA--C 1.576 1.957 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 179.262 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -65.81 103.44 0.9 Allowed 'General case' 0 CA--C 1.572 1.813 0 O-C-N 120.49 -1.381 . . . . 0.0 113.02 -176.051 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 129.79 -45.68 1.12 Allowed Glycine 0 N--CA 1.494 2.559 0 CA-C-N 115.224 -0.898 . . . . 0.0 114.816 -173.649 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mp -93.75 139.44 30.84 Favored 'General case' 0 CA--C 1.562 1.411 0 CA-C-O 122.707 1.242 . . . . 0.0 111.338 -176.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.32 151.24 21.28 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 121.787 0.803 . . . . 0.0 112.414 -177.944 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.565 ' SG ' ' HB2' ' A' ' 51' ' ' ALA . 8.8 t -92.13 124.36 36.16 Favored 'General case' 0 CA--C 1.567 1.621 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.527 173.31 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 . . . . . 0 N--CA 1.492 1.643 0 O-C-N 120.702 -1.249 . . . . 0.0 107.672 -176.555 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 . . . . . 0 N--CA 1.493 1.686 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.12 -179.26 52.53 Favored Glycine 0 N--CA 1.493 2.454 0 O-C-N 121.786 -0.571 . . . . 0.0 113.677 172.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.0 mm -115.59 137.08 50.35 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.536 0 CA-C-N 119.455 1.627 . . . . 0.0 111.62 -174.68 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.463 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 57.0 m -69.56 126.83 30.92 Favored 'General case' 0 CA--C 1.569 1.696 0 O-C-N 120.813 -1.179 . . . . 0.0 114.179 174.509 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -141.33 156.05 45.88 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 122.905 1.336 . . . . 0.0 111.115 176.547 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -93.68 77.11 4.31 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-O 124.097 1.903 . . . . 0.0 111.629 -174.881 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 93.0 t . . . . . 0 N--CA 1.496 1.826 0 CA-C-N 112.246 -2.252 . . . . 0.0 109.04 -177.322 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 . . . . . 0 CA--C 1.581 2.15 0 N-CA-C 120.844 3.646 . . . . 0.0 120.844 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.4 tp -127.81 127.29 43.26 Favored 'General case' 0 CA--C 1.58 2.106 0 O-C-N 120.679 -1.263 . . . . 0.0 108.985 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -76.13 158.73 31.43 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 119.961 -1.712 . . . . 0.0 114.895 -174.1 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.26 136.22 54.59 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 122.028 0.918 . . . . 0.0 111.216 176.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.96 -7.85 67.56 Favored Glycine 0 CA--C 1.557 2.69 0 N-CA-C 116.558 1.383 . . . . 0.0 116.558 -172.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -97.66 142.72 29.12 Favored 'General case' 0 CA--C 1.567 1.599 0 CA-C-N 119.026 1.413 . . . . 0.0 110.167 178.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.4 mp -63.99 128.09 34.28 Favored 'General case' 0 CA--C 1.573 1.835 0 CA-C-O 122.14 0.971 . . . . 0.0 112.455 -178.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -129.11 157.85 40.6 Favored 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 123.741 1.734 . . . . 0.0 113.57 -173.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.3 mt -102.76 -64.97 1.02 Allowed 'General case' 0 CA--C 1.573 1.849 0 CA-C-N 114.269 -1.332 . . . . 0.0 107.598 170.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -98.97 148.83 23.59 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.481 ' HA ' ' HB2' ' A' ' 28' ' ' CYS . 2.8 t -68.29 -22.65 64.72 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 119.819 -1.801 . . . . 0.0 112.842 169.184 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . 0.3 . . -71.68 3.4 4.09 Favored 'General case' 0 CA--C 1.58 2.121 0 N-CA-C 115.725 1.75 . . . . 0.0 115.725 171.154 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -99.83 -37.52 9.03 Favored 'General case' 0 CA--C 1.575 1.928 0 C-N-CA 126.05 1.74 . . . . 0.0 113.206 173.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 12.5 m -76.46 157.37 32.27 Favored 'General case' 0 CA--C 1.572 1.795 0 N-CA-C 116.507 2.04 . . . . 0.0 116.507 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -68.54 -59.65 2.99 Favored 'General case' 0 N--CA 1.501 2.084 0 C-N-CA 124.307 1.043 . . . . 0.0 109.016 172.506 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.7 t -81.52 104.38 11.9 Favored 'General case' 0 CA--C 1.565 1.534 0 N-CA-C 103.0 -2.963 . . . . 0.0 103.0 168.844 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -70.88 82.01 0.65 Allowed 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 124.528 2.109 . . . . 0.0 113.071 -172.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 28.8 t -155.92 81.56 1.01 Allowed 'General case' 0 CA--C 1.56 1.336 0 CA-C-N 112.157 -2.292 . . . . 0.0 109.99 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.481 ' HB2' ' HA ' ' A' ' 20' ' ' SER . 18.0 t -78.84 114.2 17.57 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 104.785 -2.302 . . . . 0.0 104.785 172.03 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -82.03 109.27 16.21 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -171.503 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.461 ' HB2' HG12 ' A' ' 57' ' ' VAL . 39.4 t-80 -77.35 108.37 10.44 Favored 'General case' 0 CA--C 1.564 1.489 0 CA-C-O 122.244 1.021 . . . . 0.0 111.132 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.1 p-10 -64.82 42.71 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.341 0 N-CA-C 119.115 3.005 . . . . 0.0 119.115 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.8 p 67.17 84.22 0.16 Allowed 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 126.049 1.74 . . . . 0.0 113.725 173.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.273 4.3 mp 72.49 -48.56 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 C-N-CA 125.292 1.437 . . . . 0.0 113.63 177.099 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.8 mt -51.68 -27.47 11.79 Favored 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 118.33 2.715 . . . . 0.0 118.33 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.251 28.4 p 76.73 -2.6 2.66 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 118.988 2.958 . . . . 0.0 118.988 174.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.5 mp -73.95 95.01 2.41 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 121.041 1.746 . . . . 0.0 106.735 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.6 m -96.55 158.55 15.38 Favored 'General case' 0 CA--C 1.567 1.616 0 CA-C-O 122.874 1.321 . . . . 0.0 113.961 -170.388 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -141.55 138.39 32.65 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.675 -1.265 . . . . 0.0 110.922 -178.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 67.3 m -63.22 143.48 57.76 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 118.448 -2.658 . . . . 0.0 113.721 176.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.95 171.86 13.49 Favored 'General case' 0 CA--C 1.564 1.509 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -173.013 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -108.02 149.26 28.63 Favored 'General case' 0 CA--C 1.569 1.68 0 CA-C-N 114.481 -1.236 . . . . 0.0 110.793 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -53.38 142.59 21.24 Favored 'General case' 0 CA--C 1.577 2.007 0 N-CA-C 116.372 1.99 . . . . 0.0 116.372 176.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.4 168.79 19.43 Favored 'General case' 0 CA--C 1.574 1.882 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -174.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 63.1 mtt-85 -116.44 162.86 16.91 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.011 -1.056 . . . . 0.0 112.183 -177.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -55.4 126.76 26.48 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -175.411 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.265 66.9 m-80 77.76 20.82 1.01 Allowed 'General case' 0 CA--C 1.584 2.254 0 C-N-CA 125.267 1.427 . . . . 0.0 114.464 -173.15 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.0 t -119.51 155.15 32.68 Favored 'General case' 0 CA--C 1.565 1.529 0 O-C-N 120.477 -1.389 . . . . 0.0 110.742 173.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -61.93 130.01 43.64 Favored 'General case' 0 CA--C 1.566 1.568 0 CA-C-O 123.21 1.481 . . . . 0.0 114.479 -176.619 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.546 ' SG ' ' HA ' ' A' ' 62' ' ' PRO . 23.4 t -133.48 145.29 50.07 Favored 'General case' 0 CA--C 1.568 1.669 0 CA-C-N 113.022 -1.899 . . . . 0.0 112.752 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.5 m -120.57 137.65 54.29 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 105.245 -2.131 . . . . 0.0 105.245 171.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -82.07 -132.32 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.144 0 O-C-N 120.512 -1.368 . . . . 0.0 113.464 -174.507 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -133.15 156.25 47.8 Favored 'General case' 0 N--CA 1.491 1.584 1 N-CA-C 125.108 5.225 . . . . 0.0 125.108 -169.086 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.351 70.3 p 63.94 128.0 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.133 1 CA-C-N 108.115 -4.129 . . . . 0.0 115.165 -178.058 . . . . . . . . 3 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.346 0.4 OUTLIER -142.85 -81.08 0.2 Allowed 'General case' 0 CA--C 1.582 2.194 1 CA-C-N 108.228 -4.078 . . . . 0.0 100.683 -173.883 . . . . . . . . 4 3 . 1 . 018 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -159.22 -16.29 0.06 Allowed 'General case' 0 CA--C 1.611 3.312 0 C-N-CA 130.194 3.398 . . . . 0.0 107.907 169.298 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 118.0 58.48 0.28 Allowed Glycine 0 CA--C 1.562 2.982 0 C-N-CA 125.373 1.463 . . . . 0.0 113.773 -170.001 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.461 HG12 ' HB2' ' A' ' 30' ' ' HIS . 16.9 t -145.15 141.45 22.81 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.756 0 CA-C-N 121.791 2.796 . . . . 0.0 106.088 139.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -125.8 131.29 52.49 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 120.782 -1.198 . . . . 0.0 113.686 -172.031 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -69.1 -29.66 67.79 Favored 'General case' 0 CA--C 1.579 2.059 0 N-CA-C 116.133 1.901 . . . . 0.0 116.133 179.082 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -149.56 125.32 10.46 Favored 'General case' 0 CA--C 1.57 1.736 0 N-CA-C 105.823 -1.918 . . . . 0.0 105.823 174.736 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.2 m -55.23 152.19 16.15 Favored Pre-proline 0 CA--C 1.596 2.746 0 N-CA-C 116.797 2.147 . . . . 0.0 116.797 -175.042 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.546 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 44.2 Cg_endo -78.45 37.48 0.64 Allowed 'Trans proline' 0 CA--C 1.569 2.271 1 N-CA-C 122.786 4.11 . . . . 0.0 122.786 -171.188 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.478 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 29.8 m 64.42 144.17 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 -178.656 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -66.24 145.94 55.19 Favored 'General case' 0 CA--C 1.569 1.677 0 O-C-N 119.816 -1.802 . . . . 0.0 112.961 176.064 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -62.97 119.76 10.06 Favored 'General case' 0 CA--C 1.565 1.538 0 CA-C-O 123.737 1.732 . . . . 0.0 114.628 -172.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 138.69 -48.76 0.86 Allowed Glycine 0 N--CA 1.49 2.299 0 CA-C-N 112.461 -2.154 . . . . 0.0 113.804 -172.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -105.08 173.69 6.2 Favored 'General case' 0 CA--C 1.575 1.915 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 175.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -100.64 155.1 18.07 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -173.616 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 37.3 t -96.36 127.8 42.69 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-N 113.324 -1.762 . . . . 0.0 110.895 172.278 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 . . . . . 0 N--CA 1.499 2.018 0 CA-C-N 120.728 1.604 . . . . 0.0 111.649 174.639 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 . . . . . 0 N--CA 1.495 1.819 0 CA-C-O 122.039 0.923 . . . . 0.0 112.213 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -86.76 -164.32 39.76 Favored Glycine 0 N--CA 1.487 2.046 0 O-C-N 121.071 -1.018 . . . . 0.0 115.457 175.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 33.9 mm -125.89 152.71 33.26 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.058 0 CA-C-O 122.882 1.325 . . . . 0.0 110.29 -174.257 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.457 ' SG ' ' HB2' ' A' ' 49' ' ' CYS . 58.6 m -76.11 122.09 23.77 Favored 'General case' 0 CA--C 1.57 1.722 0 O-C-N 120.312 -1.493 . . . . 0.0 112.379 172.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -138.51 143.01 39.34 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 123.414 1.578 . . . . 0.0 111.092 178.411 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 -98.93 137.14 37.91 Favored 'General case' 0 CA--C 1.56 1.355 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.578 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 57.9 t . . . . . 0 N--CA 1.496 1.872 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.45 -174.029 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 . . . . . 0 N--CA 1.502 2.131 0 CA-C-O 121.827 0.823 . . . . 0.0 112.642 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -138.41 157.39 46.31 Favored 'General case' 0 CA--C 1.573 1.849 0 CA-C-O 122.664 1.221 . . . . 0.0 111.941 172.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -78.11 167.19 21.82 Favored 'General case' 0 CA--C 1.569 1.693 0 O-C-N 120.337 -1.477 . . . . 0.0 113.961 -175.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -74.82 148.32 40.38 Favored 'General case' 0 CA--C 1.578 2.02 0 CA-C-O 122.312 1.053 . . . . 0.0 110.762 174.342 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.52 28.2 10.74 Favored Glycine 0 CA--C 1.56 2.888 0 N-CA-C 114.979 0.752 . . . . 0.0 114.979 -171.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -139.39 146.22 39.91 Favored 'General case' 0 CA--C 1.568 1.636 0 C-N-CA 125.157 1.383 . . . . 0.0 109.698 -175.193 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.2 tt -69.68 119.18 13.52 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 120.657 -1.277 . . . . 0.0 111.721 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 14.6 p -120.92 158.42 27.72 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -175.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -88.64 -84.79 0.2 Allowed 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 174.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.7 p30 -94.03 169.78 10.02 Favored 'General case' 0 N--CA 1.499 2.004 0 C-N-CA 124.021 0.928 . . . . 0.0 113.11 173.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.7 m -72.03 -23.08 61.33 Favored 'General case' 0 N--CA 1.504 2.261 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 174.327 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.28 12.06 1.04 Allowed 'General case' 0 CA--C 1.583 2.245 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 173.261 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 31.3 mm100 -93.1 -47.56 6.91 Favored 'General case' 0 CA--C 1.569 1.702 0 C-N-CA 125.05 1.34 . . . . 0.0 112.737 174.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 70.9 m -72.55 154.28 40.88 Favored 'General case' 0 CA--C 1.57 1.75 0 CA-C-N 120.451 1.478 . . . . 0.0 113.705 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -54.44 -57.39 11.5 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.944 -1.097 . . . . 0.0 111.1 174.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.1 m -83.75 106.31 15.35 Favored 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 103.606 -2.739 . . . . 0.0 103.606 168.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -68.89 85.0 0.32 Allowed 'General case' 0 N--CA 1.495 1.804 0 CA-C-O 124.185 1.945 . . . . 0.0 113.718 -173.2 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.7 t -151.66 73.12 1.06 Allowed 'General case' 0 CA--C 1.564 1.497 0 CA-C-N 113.01 -1.904 . . . . 0.0 111.165 -174.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 35.9 t -79.49 113.69 17.83 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 104.482 -2.414 . . . . 0.0 104.482 171.779 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -100.1 112.8 25.11 Favored 'General case' 0 CA--C 1.567 1.626 0 CA-C-O 123.179 1.466 . . . . 0.0 114.656 -170.386 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.612 ' HB2' HG12 ' A' ' 57' ' ' VAL . 0.9 OUTLIER -82.46 144.66 30.3 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 126.118 1.767 . . . . 0.0 110.9 176.023 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -82.9 75.55 9.79 Favored 'General case' 0 CA--C 1.58 2.118 0 O-C-N 120.452 -1.405 . . . . 0.0 108.186 171.424 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.415 HG23 ' H ' ' A' ' 33' ' ' ILE 0.406 11.8 t 55.04 -106.63 0.34 Allowed 'General case' 0 N--CA 1.5 2.034 0 C-N-CA 126.275 1.83 . . . . 0.0 113.207 -173.293 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.415 ' H ' HG23 ' A' ' 32' ' ' THR . 0.2 OUTLIER -103.22 -18.11 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.291 0 CA-C-N 120.68 1.582 . . . . 0.0 114.042 174.256 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.1 tp -72.74 121.74 20.35 Favored 'General case' 0 CA--C 1.569 1.707 0 CA-C-N 121.24 1.836 . . . . 0.0 108.838 173.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 82.1 p -83.86 100.49 11.01 Favored 'General case' 0 CA--C 1.568 1.654 0 N-CA-C 118.823 2.897 . . . . 0.0 118.823 -171.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 38.9 tp -149.23 87.29 1.52 Allowed 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 102.63 -3.1 . . . . 0.0 102.63 171.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 m -100.3 122.16 42.64 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 -171.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -133.49 137.27 45.57 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 124.679 1.192 . . . . 0.0 109.163 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 63.4 m -66.04 142.65 57.74 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 119.501 -1.999 . . . . 0.0 113.28 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -137.69 -172.95 3.36 Favored 'General case' 0 CA--C 1.569 1.691 0 CA-C-N 113.433 -1.712 . . . . 0.0 112.754 -174.121 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 37.8 tp -90.9 150.8 21.37 Favored 'General case' 0 CA--C 1.573 1.836 0 CA-C-O 122.264 1.031 . . . . 0.0 112.457 176.517 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -70.38 155.31 40.86 Favored 'General case' 0 CA--C 1.574 1.866 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 173.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.46 150.63 36.67 Favored 'General case' 0 CA--C 1.571 1.762 0 CA-C-O 124.561 2.124 . . . . 0.0 114.043 -174.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -124.61 168.17 13.5 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.186 -1.824 . . . . 0.0 110.857 -175.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -54.41 133.98 45.61 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.907 -1.121 . . . . 0.0 112.616 -176.299 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.391 8.8 p30 67.77 17.41 9.77 Favored 'General case' 0 CA--C 1.585 2.326 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -171.965 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.1 t -118.14 153.3 34.03 Favored 'General case' 0 CA--C 1.567 1.607 0 O-C-N 120.78 -1.2 . . . . 0.0 110.253 173.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -60.01 122.67 14.9 Favored 'General case' 0 CA--C 1.572 1.802 0 N-CA-C 117.448 2.388 . . . . 0.0 117.448 -174.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.566 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 53.2 t -142.81 132.52 23.93 Favored 'General case' 0 CA--C 1.56 1.352 0 CA-C-N 113.816 -1.538 . . . . 0.0 110.848 173.226 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 27.9 t -139.69 158.74 43.6 Favored 'General case' 0 CA--C 1.568 1.666 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 172.164 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -119.13 126.36 51.42 Favored 'General case' 0 CA--C 1.571 1.751 0 CA-C-O 124.599 2.142 . . . . 0.0 112.169 -173.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 19.8 p90 -146.47 -142.16 0.12 Allowed 'General case' 0 CA--C 1.579 2.095 0 CA-C-N 111.942 -2.39 . . . . 0.0 108.324 -172.287 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.0 m -63.95 111.33 2.45 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 119.537 -1.977 . . . . 0.0 109.336 171.878 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.458 2.3 mt -112.1 42.16 1.82 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 117.83 2.53 . . . . 0.0 117.83 -178.76 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . 0.362 0.5 OUTLIER -153.7 29.87 0.47 Allowed 'General case' 0 CA--C 1.583 2.246 0 CA-C-N 113.353 -1.749 . . . . 0.0 112.141 166.541 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -123.18 -131.86 3.88 Favored Glycine 0 CA--C 1.548 2.155 0 N-CA-C 108.722 -1.751 . . . . 0.0 108.722 172.28 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.612 HG12 ' HB2' ' A' ' 30' ' ' HIS . 14.2 t -101.84 144.09 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.503 0 O-C-N 121.169 -1.195 . . . . 0.0 108.795 170.267 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 15.3 m-30 -114.21 136.9 52.44 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 -169.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.36 -48.6 55.59 Favored 'General case' 0 CA--C 1.578 2.048 0 O-C-N 120.886 -1.134 . . . . 0.0 112.723 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.407 ' H ' ' HE2' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -137.12 113.6 10.14 Favored 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 102.155 -3.276 . . . . 0.0 102.155 172.771 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 60.8 m -54.4 148.55 23.74 Favored Pre-proline 0 CA--C 1.587 2.387 0 N-CA-C 115.008 1.485 . . . . 0.0 115.008 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -64.74 169.06 12.12 Favored 'Trans proline' 0 CA--C 1.568 2.206 0 C-N-CA 122.384 2.056 . . . . 0.0 116.602 -173.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 83.8 m -67.72 154.03 42.41 Favored 'General case' 0 CA--C 1.572 1.824 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 -178.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.86 173.99 2.07 Favored 'General case' 0 CA--C 1.579 2.081 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -62.65 108.1 1.09 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.551 -1.343 . . . . 0.0 112.363 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 112.1 -22.51 18.21 Favored Glycine 0 N--CA 1.497 2.743 0 N-CA-C 117.749 1.859 . . . . 0.0 117.749 -173.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.9 mp -98.9 152.21 20.01 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-N 119.064 1.432 . . . . 0.0 112.531 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.3 159.49 15.21 Favored 'General case' 0 CA--C 1.564 1.487 0 CA-C-O 122.508 1.147 . . . . 0.0 112.556 177.531 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 4.9 t -89.44 96.54 10.75 Favored 'General case' 0 CA--C 1.573 1.845 0 N-CA-C 105.95 -1.87 . . . . 0.0 105.95 172.35 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 . . . . . 0 N--CA 1.495 1.812 0 O-C-N 120.69 -1.256 . . . . 0.0 114.374 -171.103 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.7 m-30 . . . . . 0 N--CA 1.499 2.006 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -94.25 -162.75 35.54 Favored Glycine 0 N--CA 1.488 2.15 0 CA-C-N 115.083 -0.962 . . . . 0.0 113.752 173.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.1 mm -135.53 142.74 38.65 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.009 0 O-C-N 121.761 -0.846 . . . . 0.0 110.537 -176.319 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.566 ' SG ' ' HB2' ' A' ' 49' ' ' CYS . 19.3 m -70.79 130.31 41.36 Favored 'General case' 0 CA--C 1.569 1.709 0 O-C-N 120.169 -1.582 . . . . 0.0 113.375 173.059 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -143.33 155.07 44.35 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 123.228 1.49 . . . . 0.0 112.439 175.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -97.95 73.99 2.29 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 122.794 1.283 . . . . 0.0 111.617 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.501 2.124 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -179.492 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 . . . . . 0 N--CA 1.495 1.784 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.4 tp -150.23 115.33 5.38 Favored 'General case' 0 CA--C 1.577 1.998 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 173.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -75.55 162.31 28.4 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 115.845 1.795 . . . . 0.0 115.845 -172.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.91 140.86 56.38 Favored 'General case' 0 CA--C 1.574 1.869 0 CA-C-O 122.481 1.134 . . . . 0.0 113.809 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.91 2.35 61.12 Favored Glycine 0 N--CA 1.496 2.659 0 N-CA-C 117.856 1.902 . . . . 0.0 117.856 -174.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -112.42 133.04 54.72 Favored 'General case' 0 CA--C 1.566 1.565 0 CA-C-N 118.935 1.367 . . . . 0.0 110.082 -175.027 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.9 tt -68.33 119.86 13.52 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.424 -0.797 . . . . 0.0 111.834 -176.093 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 24.7 p -128.07 158.42 38.01 Favored 'General case' 0 CA--C 1.558 1.268 0 CA-C-O 122.35 1.072 . . . . 0.0 112.798 -175.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.8 mt -92.98 -73.67 0.55 Allowed 'General case' 0 CA--C 1.568 1.664 0 O-C-N 120.835 -1.166 . . . . 0.0 108.61 173.392 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -91.94 150.75 20.85 Favored 'General case' 0 CA--C 1.569 1.674 0 N-CA-C 115.822 1.786 . . . . 0.0 115.822 178.447 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.1 m -68.56 -16.51 63.89 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 124.93 1.292 . . . . 0.0 114.162 170.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . 0.325 . . -75.03 28.64 0.09 Allowed 'General case' 0 CA--C 1.594 2.645 0 C-N-CA 126.608 1.963 . . . . 0.0 114.036 171.743 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -138.52 -39.52 0.52 Allowed 'General case' 0 CA--C 1.583 2.217 0 C-N-CA 127.731 2.413 . . . . 0.0 113.126 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.9 m -65.18 -171.67 0.08 Allowed 'General case' 0 CA--C 1.587 2.388 0 CA-C-N 121.817 2.099 . . . . 0.0 115.201 -177.21 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -70.12 -57.63 4.73 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 119.101 -2.249 . . . . 0.0 115.225 -175.131 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 36.3 m -82.37 -78.87 0.19 Allowed 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 173.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -174.49 68.95 0.03 OUTLIER 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 173.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.3 t -151.87 94.24 1.95 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 118.885 -2.385 . . . . 0.0 116.553 -174.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 26.3 t -95.63 112.61 24.29 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 101.283 -3.599 . . . . 0.0 101.283 168.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -91.7 124.06 35.56 Favored 'General case' 0 CA--C 1.562 1.421 0 CA-C-O 122.548 1.166 . . . . 0.0 113.786 -171.625 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.431 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.7 t60 -79.27 131.96 36.32 Favored 'General case' 0 CA--C 1.56 1.361 0 C-N-CA 125.098 1.359 . . . . 0.0 112.031 -174.585 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.83 31.29 0.09 Allowed 'General case' 0 CA--C 1.585 2.293 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.253 24.9 p 70.31 100.69 0.06 Allowed 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 126.47 1.908 . . . . 0.0 112.096 179.101 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.29 3.7 mp 72.83 -63.66 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 C-N-CA 125.477 1.511 . . . . 0.0 111.614 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.7 tp -68.26 128.89 38.21 Favored 'General case' 0 CA--C 1.571 1.755 0 CA-C-N 120.624 1.556 . . . . 0.0 110.776 174.157 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.9 p -86.65 31.5 0.68 Allowed 'General case' 0 CA--C 1.571 1.782 0 N-CA-C 118.954 2.946 . . . . 0.0 118.954 -173.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 31.3 tp -82.42 93.61 7.25 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 172.496 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.1 m -97.35 148.93 22.66 Favored 'General case' 0 CA--C 1.566 1.56 0 CA-C-O 123.325 1.536 . . . . 0.0 114.022 -170.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 57.2 ttm-85 -141.2 137.2 32.47 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.197 -0.939 . . . . 0.0 109.676 -176.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 58.7 m -61.07 140.09 57.94 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 119.632 -1.917 . . . . 0.0 111.896 175.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.69 178.12 7.46 Favored 'General case' 0 CA--C 1.565 1.548 0 N-CA-C 116.492 2.034 . . . . 0.0 116.492 -172.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.8 tp -86.77 149.6 24.75 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-O 122.26 1.029 . . . . 0.0 112.248 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -67.12 141.1 57.54 Favored 'General case' 0 CA--C 1.572 1.793 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 174.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.412 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . . . -75.73 162.12 28.48 Favored 'General case' 0 CA--C 1.571 1.774 0 CA-C-O 124.181 1.943 . . . . 0.0 115.173 -176.397 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -111.09 -178.81 3.56 Favored 'General case' 0 CA--C 1.567 1.61 0 CA-C-N 113.397 -1.729 . . . . 0.0 113.082 -173.476 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -60.0 135.34 57.68 Favored 'General case' 0 CA--C 1.568 1.648 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -176.081 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 66.72 38.14 4.0 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 124.902 1.281 . . . . 0.0 113.307 -173.514 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 10.9 t -128.19 140.36 51.95 Favored 'General case' 0 CA--C 1.561 1.391 0 O-C-N 121.011 -1.055 . . . . 0.0 111.991 178.599 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -73.06 97.05 2.27 Favored 'General case' 0 CA--C 1.572 1.793 0 C-N-CA 124.13 0.972 . . . . 0.0 112.226 178.272 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.16 136.48 36.57 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-O 122.117 0.961 . . . . 0.0 112.057 177.368 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 91.8 p -88.06 116.12 26.02 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 105.226 -2.139 . . . . 0.0 105.226 171.226 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -80.02 -117.9 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.964 0 CA-C-O 116.219 -1.848 . . . . 0.0 114.583 -172.506 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -130.42 154.0 48.18 Favored 'General case' 0 CA--C 1.567 1.6 1 N-CA-C 123.486 4.625 . . . . 0.0 123.486 -170.165 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.434 24.0 p 43.29 122.15 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.258 0 CA-C-N 108.4 -4.0 . . . . 0.0 116.378 -172.448 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.775 HD23 ' H ' ' A' ' 56' ' ' GLY 0.418 0.0 OUTLIER -145.54 -71.55 0.26 Allowed 'General case' 0 CA--C 1.576 1.946 1 CA-C-N 107.695 -4.32 . . . . 0.0 102.142 -173.309 . . . . . . . . 5 4 . 1 . 020 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.626 ' H ' HD23 ' A' ' 54' ' ' LEU . 52.6 t80 -158.99 -30.77 0.07 Allowed 'General case' 0 CA--C 1.591 2.55 0 C-N-CA 127.694 2.398 . . . . 0.0 110.474 171.645 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.775 ' H ' HD23 ' A' ' 54' ' ' LEU . . . 122.93 43.82 0.35 Allowed Glycine 0 CA--C 1.556 2.605 0 N-CA-C 117.436 1.735 . . . . 0.0 117.436 -172.364 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.431 HG12 ' HB2' ' A' ' 30' ' ' HIS . 11.3 t -138.84 132.68 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.422 0 CA-C-N 122.958 3.379 . . . . 0.0 106.428 145.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -117.84 132.11 56.48 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.744 -172.16 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -61.97 -42.62 99.33 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 120.038 -1.663 . . . . 0.0 115.402 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -142.76 119.27 11.0 Favored 'General case' 0 CA--C 1.562 1.408 0 N-CA-C 105.277 -2.12 . . . . 0.0 105.277 174.544 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 84.2 m -44.17 148.95 0.75 Allowed Pre-proline 0 CA--C 1.593 2.607 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 -176.496 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -70.05 42.23 0.36 Allowed 'Trans proline' 0 CA--C 1.574 2.519 1 N-CA-C 122.521 4.008 . . . . 0.0 122.521 -171.256 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.412 ' SG ' ' HB3' ' A' ' 43' ' ' ALA . 67.6 m 58.98 154.13 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 117.516 2.413 . . . . 0.0 117.516 175.761 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -62.27 151.83 35.31 Favored 'General case' 0 CA--C 1.573 1.837 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -179.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -68.98 104.08 2.0 Favored 'General case' 0 CA--C 1.573 1.84 0 CA-C-O 122.38 1.086 . . . . 0.0 112.324 -174.664 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 136.44 -29.49 2.79 Favored Glycine 0 N--CA 1.497 2.742 0 N-CA-C 116.108 1.203 . . . . 0.0 116.108 -173.006 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.5 mp -96.88 144.6 26.67 Favored 'General case' 0 CA--C 1.566 1.567 0 C-N-CA 124.372 1.069 . . . . 0.0 111.538 177.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -99.43 135.77 40.36 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 122.012 0.911 . . . . 0.0 111.567 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 30.3 t -94.99 113.89 25.64 Favored 'General case' 0 CA--C 1.568 1.641 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.669 175.392 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 N--CA 1.501 2.095 0 O-C-N 120.122 -1.611 . . . . 0.0 113.319 -174.317 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 . . . . . 0 N--CA 1.5 2.026 0 CA-C-O 122.726 1.25 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -73.6 135.61 20.9 Favored Glycine 0 N--CA 1.487 2.048 0 N-CA-C 116.645 1.418 . . . . 0.0 116.645 -179.047 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.6 mm -89.76 134.15 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 CA-C-O 122.743 1.259 . . . . 0.0 109.047 -174.778 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 69.6 m -80.81 122.42 27.16 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -132.79 153.02 51.65 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 122.733 1.254 . . . . 0.0 110.701 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -93.61 127.14 39.14 Favored 'General case' 0 CA--C 1.56 1.36 0 CA-C-O 122.834 1.302 . . . . 0.0 110.617 -174.592 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.4 p . . . . . 0 N--CA 1.494 1.763 0 CA-C-N 114.124 -1.398 . . . . 0.0 113.422 -173.684 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.253 69.3 m-80 . . . . . 0 N--CA 1.505 2.312 0 CA-C-O 122.441 1.115 . . . . 0.0 111.308 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.4 ' H ' ' HA ' ' A' ' 23' ' ' CYS . 1.7 pt? -141.75 164.3 30.56 Favored 'General case' 0 CA--C 1.577 2.011 0 CA-C-O 122.519 1.152 . . . . 0.0 111.491 173.746 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -80.14 167.34 20.48 Favored 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 116.291 1.96 . . . . 0.0 116.291 -173.231 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -72.03 138.91 48.25 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.433 0.693 . . . . 0.0 110.418 175.005 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 92.83 5.84 64.14 Favored Glycine 0 CA--C 1.558 2.766 0 N-CA-C 116.23 1.252 . . . . 0.0 116.23 -172.149 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -109.09 144.38 37.2 Favored 'General case' 0 CA--C 1.567 1.611 0 CA-C-N 119.002 1.401 . . . . 0.0 109.925 174.475 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 tt -67.4 115.45 7.06 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -174.744 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.5 p -110.91 152.82 26.3 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 124.359 1.063 . . . . 0.0 113.264 179.411 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.3 mt -84.54 -78.69 0.24 Allowed 'General case' 0 CA--C 1.568 1.657 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 174.127 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -96.09 177.85 5.6 Favored 'General case' 0 CA--C 1.578 2.052 0 O-C-N 121.202 -0.936 . . . . 0.0 113.191 172.795 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.1 m -77.37 -19.37 56.32 Favored 'General case' 0 N--CA 1.504 2.25 0 N-CA-C 116.48 2.03 . . . . 0.0 116.48 174.894 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.32 17.71 0.47 Allowed 'General case' 0 CA--C 1.581 2.164 0 N-CA-C 116.655 2.095 . . . . 0.0 116.655 173.939 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -96.9 -48.87 5.26 Favored 'General case' 0 CA--C 1.57 1.723 0 C-N-CA 125.127 1.371 . . . . 0.0 114.1 -177.194 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.4 ' HA ' ' H ' ' A' ' 11' ' ' LEU . 87.9 m -81.19 170.63 15.89 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 115.965 1.839 . . . . 0.0 115.965 -177.4 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -63.06 -55.83 22.15 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 123.561 0.745 . . . . 0.0 109.283 171.531 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.4 t -82.56 100.4 10.1 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 104.166 -2.531 . . . . 0.0 104.166 169.077 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -72.67 71.86 1.01 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 125.081 2.372 . . . . 0.0 114.39 -173.642 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.411 ' SG ' ' HB3' ' A' ' 40' ' ' ALA . 2.1 t -148.02 86.19 1.56 Allowed 'General case' 0 CA--C 1.559 1.316 0 CA-C-N 112.373 -2.194 . . . . 0.0 109.513 -173.531 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.7 t -80.66 119.5 23.37 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 120.586 -1.321 . . . . 0.0 107.908 173.857 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.9 tp60 -101.42 117.51 35.08 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.542 1.137 . . . . 0.0 113.22 -172.96 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 8.4 m170 -60.73 159.59 10.69 Favored 'General case' 0 CA--C 1.567 1.603 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 177.162 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -89.91 60.37 4.92 Favored 'General case' 0 CA--C 1.578 2.04 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 171.126 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.7 m 80.96 -75.3 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.191 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 -169.06 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.0 mt -138.2 -115.25 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.584 2.253 0 N-CA-C 103.502 -2.777 . . . . 0.0 103.502 172.535 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.251 3.8 mm? 41.59 -107.89 0.09 Allowed 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 127.123 2.169 . . . . 0.0 114.806 174.56 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 89.8 p -152.1 -111.3 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.315 0 CA-C-O 116.133 -1.889 . . . . 0.0 109.709 173.27 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.0 tp 23.24 60.97 0.04 OUTLIER 'General case' 0 N--CA 1.514 2.761 0 CA-C-N 121.362 1.892 . . . . 0.0 115.683 -174.35 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 45.2 m -99.17 119.15 37.39 Favored 'General case' 0 CA--C 1.554 1.098 0 CA-C-N 114.257 -1.338 . . . . 0.0 112.298 -170.664 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -99.11 165.65 11.62 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.961 -0.462 . . . . 0.0 110.469 175.083 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 45.9 m -80.59 152.16 28.71 Favored 'General case' 0 CA--C 1.563 1.475 0 O-C-N 119.064 -2.272 . . . . 0.0 112.12 173.447 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.411 ' HB3' ' SG ' ' A' ' 27' ' ' CYS . . . -140.66 -178.76 5.67 Favored 'General case' 0 CA--C 1.569 1.675 0 CA-C-N 113.282 -1.781 . . . . 0.0 112.689 -173.915 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -88.42 137.32 32.43 Favored 'General case' 0 CA--C 1.568 1.642 0 O-C-N 121.01 -1.056 . . . . 0.0 112.571 179.629 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.97 155.42 30.8 Favored 'General case' 0 CA--C 1.576 1.979 0 CA-C-O 121.868 0.842 . . . . 0.0 110.709 172.422 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.53 156.43 27.77 Favored 'General case' 0 CA--C 1.568 1.642 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 -173.634 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 22.7 mtm180 -129.29 172.93 10.99 Favored 'General case' 0 CA--C 1.563 1.47 0 CA-C-N 112.806 -1.997 . . . . 0.0 109.761 177.558 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -48.77 130.45 17.73 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 115.62 1.711 . . . . 0.0 115.62 -173.891 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.8 m120 77.19 10.24 2.52 Favored 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 -174.182 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 30.7 t -109.26 148.75 30.48 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 120.532 1.514 . . . . 0.0 112.268 175.277 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -79.76 112.56 17.16 Favored 'General case' 0 CA--C 1.57 1.744 0 CA-C-O 123.839 1.781 . . . . 0.0 112.747 -178.346 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.97 177.4 5.44 Favored 'General case' 0 CA--C 1.571 1.772 0 CA-C-N 112.304 -2.225 . . . . 0.0 111.048 173.639 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.432 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 58.3 m -79.65 -113.03 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 104.872 -2.27 . . . . 0.0 104.872 170.017 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -160.17 -80.53 0.05 OUTLIER 'General case' 0 CA--C 1.564 1.486 0 CA-C-N 122.862 2.573 . . . . 0.0 110.788 172.272 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -77.63 -46.34 22.36 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 174.743 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.9 p 60.74 153.62 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 124.954 2.312 . . . . 0.0 116.447 -176.858 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.53 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.6 pt? -97.59 179.45 4.84 Favored 'General case' 0 CA--C 1.583 2.234 0 CA-C-N 112.71 -2.041 . . . . 0.0 108.685 171.985 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -84.76 12.84 6.54 Favored 'General case' 0 N--CA 1.514 2.743 0 O-C-N 118.422 -2.674 . . . . 0.0 114.036 174.009 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.45 ' H ' ' HG ' ' A' ' 54' ' ' LEU . . . -113.41 -152.42 11.0 Favored Glycine 0 N--CA 1.476 1.357 0 O-C-N 120.99 -1.069 . . . . 0.0 114.226 -173.831 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.5 t -78.49 142.08 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 CA-C-O 122.912 1.339 . . . . 0.0 111.314 -167.442 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -119.51 153.61 35.09 Favored 'General case' 0 CA--C 1.561 1.393 0 N-CA-C 116.468 2.025 . . . . 0.0 116.468 -171.329 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -83.03 -56.08 4.0 Favored 'General case' 0 CA--C 1.577 2.016 0 CA-C-N 113.253 -1.794 . . . . 0.0 110.077 172.964 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -133.16 108.01 8.54 Favored 'General case' 0 CA--C 1.564 1.505 0 N-CA-C 104.606 -2.368 . . . . 0.0 104.606 173.448 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.6 m -52.11 153.06 5.08 Favored Pre-proline 0 CA--C 1.584 2.259 0 N-CA-C 118.433 2.753 . . . . 0.0 118.433 -175.333 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -70.31 172.29 13.45 Favored 'Trans proline' 0 CA--C 1.568 2.204 0 C-N-CA 122.687 2.258 . . . . 0.0 115.574 -177.904 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 60.4 m -70.77 156.39 39.58 Favored 'General case' 0 CA--C 1.571 1.754 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 177.312 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.53 168.55 3.56 Favored 'General case' 0 CA--C 1.58 2.099 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 174.793 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 91.5 mtt180 -63.03 112.16 2.48 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.227 -1.546 . . . . 0.0 113.492 -175.52 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 114.42 -22.83 13.0 Favored Glycine 0 N--CA 1.495 2.622 0 N-CA-C 118.926 2.33 . . . . 0.0 118.926 -173.984 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.7 mp -99.43 143.76 29.31 Favored 'General case' 0 CA--C 1.572 1.792 0 CA-C-N 119.462 1.631 . . . . 0.0 112.877 -176.02 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -102.23 155.44 18.22 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 124.116 0.967 . . . . 0.0 113.413 -177.308 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.432 ' SG ' ' O ' ' A' ' 50' ' ' SER . 1.9 t -94.67 83.71 4.12 Favored 'General case' 0 CA--C 1.579 2.079 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 179.684 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 . . . . . 0 N--CA 1.497 1.893 0 O-C-N 120.476 -1.39 . . . . 0.0 112.034 -176.703 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.9 m-30 . . . . . 0 N--CA 1.497 1.9 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -160.55 167.31 35.69 Favored Glycine 0 CA--C 1.556 2.61 0 C-N-CA 124.895 1.236 . . . . 0.0 112.866 -179.573 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.5 mm -98.35 134.14 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.519 0 O-C-N 119.582 -2.128 . . . . 0.0 110.436 -179.388 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 94.9 m -63.21 123.83 19.64 Favored 'General case' 0 CA--C 1.572 1.792 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 174.662 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 79.0 m-70 -144.33 155.48 43.83 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-O 122.553 1.168 . . . . 0.0 111.613 175.57 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 40.0 t-20 -96.71 122.92 40.18 Favored 'General case' 0 CA--C 1.566 1.594 0 O-C-N 120.892 -1.13 . . . . 0.0 110.354 179.433 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 N--CA 1.498 1.96 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 -174.964 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.307 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.205 0 N-CA-C 116.656 2.095 . . . . 0.0 116.656 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 tp -132.34 120.49 22.14 Favored 'General case' 0 CA--C 1.569 1.707 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 -174.853 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -81.78 173.55 12.18 Favored 'General case' 0 CA--C 1.569 1.693 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 -172.659 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -56.37 137.87 51.94 Favored 'General case' 0 CA--C 1.568 1.652 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 176.787 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.8 -17.49 27.6 Favored Glycine 0 N--CA 1.497 2.734 0 N-CA-C 118.122 2.009 . . . . 0.0 118.122 -177.162 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -100.3 145.56 27.99 Favored 'General case' 0 CA--C 1.564 1.503 0 CA-C-N 118.428 1.114 . . . . 0.0 112.216 -177.251 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 72.6 mt -77.9 137.55 38.42 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 122.08 0.943 . . . . 0.0 113.119 -179.634 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.6 p -138.62 149.65 45.44 Favored 'General case' 0 CA--C 1.562 1.417 0 CA-C-O 122.073 0.939 . . . . 0.0 112.827 -174.567 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 98.7 mt -84.38 -74.04 0.4 Allowed 'General case' 0 CA--C 1.567 1.616 0 O-C-N 121.424 -0.797 . . . . 0.0 109.126 174.434 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.8 p30 -95.06 173.58 7.51 Favored 'General case' 0 CA--C 1.577 1.984 0 CA-C-N 120.111 1.323 . . . . 0.0 113.473 172.846 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.8 m -78.69 -19.27 52.86 Favored 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 116.994 2.22 . . . . 0.0 116.994 174.923 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.72 31.62 0.16 Allowed 'General case' 0 CA--C 1.579 2.083 0 N-CA-C 116.685 2.105 . . . . 0.0 116.685 174.342 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -114.72 -34.77 5.05 Favored 'General case' 0 CA--C 1.576 1.977 0 C-N-CA 126.414 1.886 . . . . 0.0 113.003 174.393 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . 0.273 67.3 m -80.67 -133.82 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.909 0 CA-C-N 120.87 1.668 . . . . 0.0 114.533 -174.983 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.3 -77.43 0.19 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 119.238 -2.164 . . . . 0.0 112.378 -173.777 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 77.4 p -88.33 -63.86 1.23 Allowed 'General case' 0 CA--C 1.568 1.653 0 CA-C-O 122.547 1.165 . . . . 0.0 110.481 173.09 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -169.66 81.78 0.12 Allowed 'General case' 0 CA--C 1.568 1.665 0 N-CA-C 103.991 -2.596 . . . . 0.0 103.991 177.416 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 53.5 t -140.85 62.98 1.47 Allowed 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 118.634 2.827 . . . . 0.0 118.634 -171.71 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 22.7 t -93.39 116.68 29.23 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 170.796 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.31 118.42 36.85 Favored 'General case' 0 CA--C 1.57 1.718 0 CA-C-O 122.663 1.221 . . . . 0.0 113.716 -172.367 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.517 ' HB2' HG12 ' A' ' 57' ' ' VAL . 5.6 t-160 -84.13 125.09 31.83 Favored 'General case' 0 CA--C 1.564 1.491 0 C-N-CA 124.921 1.289 . . . . 0.0 111.184 -178.025 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . 0.3 0.3 OUTLIER -83.41 57.64 4.12 Favored 'General case' 0 CA--C 1.58 2.117 0 O-C-N 120.735 -1.228 . . . . 0.0 114.252 175.191 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.351 18.3 p 90.83 178.77 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.756 0 C-N-CA 127.13 2.172 . . . . 0.0 112.354 -174.897 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 14.8 mm -59.86 -62.45 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 119.616 -1.928 . . . . 0.0 115.282 -172.695 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.5 tp -92.62 79.93 4.82 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-N 120.184 1.356 . . . . 0.0 108.863 174.951 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.3 p -145.96 172.23 13.67 Favored 'General case' 0 CA--C 1.568 1.67 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 -173.194 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 39.9 tp -88.16 140.08 29.85 Favored 'General case' 0 CA--C 1.574 1.865 0 CA-C-O 121.682 0.753 . . . . 0.0 111.507 174.514 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.5 m -104.61 110.92 23.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.951 -1.093 . . . . 0.0 112.063 -175.024 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.5 ttp180 -121.12 142.02 50.26 Favored 'General case' 0 CA--C 1.567 1.629 0 C-N-CA 124.21 1.004 . . . . 0.0 109.758 178.615 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 55.2 m -69.81 150.78 46.49 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-O 124.776 2.227 . . . . 0.0 114.323 179.03 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -132.39 -178.39 4.9 Favored 'General case' 0 CA--C 1.562 1.442 0 CA-C-N 111.774 -2.466 . . . . 0.0 113.111 -174.18 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.1 mt -84.89 138.19 32.68 Favored 'General case' 0 CA--C 1.567 1.597 0 O-C-N 121.242 -0.911 . . . . 0.0 111.742 177.75 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -68.4 139.64 55.8 Favored 'General case' 0 CA--C 1.576 1.945 0 O-C-N 121.56 -0.712 . . . . 0.0 111.065 173.841 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.39 151.31 39.72 Favored 'General case' 0 CA--C 1.57 1.712 0 N-CA-C 118.122 2.638 . . . . 0.0 118.122 -171.359 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 50.5 mtp180 -104.1 168.95 8.78 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 112.809 -1.996 . . . . 0.0 111.866 -178.903 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -52.77 126.68 20.81 Favored 'General case' 0 CA--C 1.573 1.837 0 N-CA-C 114.222 1.194 . . . . 0.0 114.222 -174.915 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 71.66 32.65 1.95 Allowed 'General case' 0 N--CA 1.503 2.214 0 C-N-CA 125.132 1.373 . . . . 0.0 113.599 -172.951 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.7 m -130.24 153.49 48.55 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.685 -1.26 . . . . 0.0 111.033 174.83 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -69.98 136.1 50.1 Favored 'General case' 0 CA--C 1.574 1.882 0 CA-C-O 124.002 1.858 . . . . 0.0 114.412 -176.177 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.434 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 26.7 p -138.93 148.25 43.32 Favored 'General case' 0 CA--C 1.566 1.593 0 CA-C-N 112.563 -2.108 . . . . 0.0 111.496 -178.372 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.3 m -78.25 107.76 11.09 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.277 -1.514 . . . . 0.0 108.253 174.299 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.34 -40.14 62.36 Favored 'General case' 0 CA--C 1.57 1.718 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -174.618 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -86.36 145.65 26.8 Favored 'General case' 0 CA--C 1.571 1.781 0 C-N-CA 124.344 1.058 . . . . 0.0 109.202 172.278 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.7 p -123.93 145.7 48.96 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-O 123.796 1.76 . . . . 0.0 109.867 173.406 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.264 0.6 OUTLIER -109.1 -135.25 0.35 Allowed 'General case' 0 CA--C 1.565 1.55 0 CA-C-N 113.404 -1.725 . . . . 0.0 106.668 174.551 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -130.95 71.34 1.47 Allowed 'General case' 0 CA--C 1.569 1.69 0 N-CA-C 104.023 -2.584 . . . . 0.0 104.023 170.178 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 169.74 -159.72 32.52 Favored Glycine 0 N--CA 1.486 1.968 0 N-CA-C 117.125 1.61 . . . . 0.0 117.125 -174.177 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.517 HG12 ' HB2' ' A' ' 30' ' ' HIS . 5.2 t -79.19 146.92 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.99 0 CA-C-O 122.343 1.068 . . . . 0.0 112.277 -166.801 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -123.87 158.41 31.95 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -173.153 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -86.16 -21.91 27.3 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 174.373 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -146.37 122.8 11.01 Favored 'General case' 0 CA--C 1.564 1.519 0 N-CA-C 105.507 -2.035 . . . . 0.0 105.507 177.826 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.473 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 56.9 m -58.91 134.05 87.07 Favored Pre-proline 0 CA--C 1.597 2.775 0 O-C-N 119.888 -1.758 . . . . 0.0 115.27 -179.907 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 61' ' ' CYS . 36.5 Cg_exo -66.76 64.77 0.56 Allowed 'Trans proline' 0 CA--C 1.581 2.825 0 N-CA-C 121.307 3.541 . . . . 0.0 121.307 -174.064 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 69.1 m 58.53 164.0 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 175.838 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -79.21 166.27 22.36 Favored 'General case' 0 CA--C 1.576 1.977 0 O-C-N 120.64 -1.287 . . . . 0.0 113.934 174.287 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -63.43 115.29 4.49 Favored 'General case' 0 CA--C 1.573 1.864 0 O-C-N 120.965 -1.085 . . . . 0.0 113.612 -178.05 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 107.31 -17.99 36.46 Favored Glycine 0 N--CA 1.5 2.931 0 N-CA-C 118.311 2.084 . . . . 0.0 118.311 -174.193 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.1 mp -98.04 151.81 19.94 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-N 118.584 1.192 . . . . 0.0 111.638 179.049 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -100.26 149.87 23.14 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.835 -1.166 . . . . 0.0 112.192 175.982 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 11.8 t -92.6 120.03 32.64 Favored 'General case' 0 CA--C 1.567 1.634 0 CA-C-N 115.07 -0.968 . . . . 0.0 108.892 172.924 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 . . . . . 0 N--CA 1.492 1.654 0 O-C-N 120.748 -1.22 . . . . 0.0 110.991 -174.031 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 122.426 1.107 . . . . 0.0 112.212 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.39 157.57 51.64 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 115.717 1.047 . . . . 0.0 115.717 177.314 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 33.3 mm -104.52 140.41 22.66 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 121.22 -1.165 . . . . 0.0 110.925 -172.224 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.434 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 89.6 m -72.22 122.92 21.87 Favored 'General case' 0 CA--C 1.566 1.561 0 O-C-N 120.567 -1.333 . . . . 0.0 113.465 174.637 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -133.55 151.36 51.72 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.825 -1.172 . . . . 0.0 110.393 176.296 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -94.36 127.3 40.16 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 122.517 1.151 . . . . 0.0 111.271 -174.374 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 N--CA 1.501 2.09 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 -173.97 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 . . . . . 0 N--CA 1.5 2.045 0 N-CA-C 117.495 2.406 . . . . 0.0 117.495 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . 0.25 28.3 tp -110.13 133.78 52.87 Favored 'General case' 0 CA--C 1.581 2.136 0 O-C-N 120.665 -1.272 . . . . 0.0 109.392 174.42 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -77.18 160.5 28.91 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 119.509 -1.995 . . . . 0.0 115.369 -173.934 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.38 128.25 34.98 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 122.215 1.007 . . . . 0.0 109.855 173.409 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 96.89 24.37 13.32 Favored Glycine 0 CA--C 1.557 2.663 0 N-CA-C 116.423 1.329 . . . . 0.0 116.423 -172.967 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -129.27 139.25 51.87 Favored 'General case' 0 CA--C 1.567 1.63 0 CA-C-N 118.533 1.167 . . . . 0.0 109.427 177.638 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.8 mp -65.7 128.74 37.18 Favored 'General case' 0 CA--C 1.574 1.891 0 O-C-N 120.919 -1.113 . . . . 0.0 112.746 -178.063 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.0 p -129.16 154.09 47.08 Favored 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 -174.313 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.4 mt -85.46 -76.82 0.31 Allowed 'General case' 0 CA--C 1.568 1.64 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 173.919 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.8 p30 -97.35 172.92 7.47 Favored 'General case' 0 CA--C 1.577 2.002 0 CA-C-N 120.003 1.274 . . . . 0.0 113.747 172.915 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.6 m -77.75 -20.63 53.1 Favored 'General case' 0 N--CA 1.505 2.28 0 N-CA-C 116.956 2.206 . . . . 0.0 116.956 175.001 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.58 10.74 1.56 Allowed 'General case' 0 CA--C 1.575 1.928 0 N-CA-C 117.292 2.33 . . . . 0.0 117.292 174.951 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -97.17 -29.28 13.68 Favored 'General case' 0 CA--C 1.576 1.964 0 C-N-CA 125.152 1.381 . . . . 0.0 114.224 173.972 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 5.3 m -80.78 159.31 25.19 Favored 'General case' 0 CA--C 1.574 1.87 0 N-CA-C 115.081 1.511 . . . . 0.0 115.081 -179.521 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.7 mptt -63.51 -57.31 10.59 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 120.843 -1.161 . . . . 0.0 108.906 170.717 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.8 t -82.02 104.19 12.2 Favored 'General case' 0 CA--C 1.565 1.548 0 N-CA-C 104.537 -2.394 . . . . 0.0 104.537 170.166 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -68.59 82.31 0.27 Allowed 'General case' 0 N--CA 1.5 2.056 0 CA-C-O 124.411 2.053 . . . . 0.0 113.445 -172.89 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 49.7 t -160.7 87.17 0.74 Allowed 'General case' 0 CA--C 1.558 1.272 0 CA-C-N 112.499 -2.137 . . . . 0.0 111.421 -177.284 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 37.1 t -79.16 110.7 14.67 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 102.911 -2.996 . . . . 0.0 102.911 170.557 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.69 112.82 24.9 Favored 'General case' 0 CA--C 1.557 1.218 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -170.384 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.545 ' HB2' HG12 ' A' ' 57' ' ' VAL . 15.6 t-80 -81.02 141.18 34.65 Favored 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 124.822 1.249 . . . . 0.0 113.126 -175.702 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.2 p-10 -69.45 17.32 0.05 OUTLIER 'General case' 0 CA--C 1.591 2.558 0 N-CA-C 117.753 2.501 . . . . 0.0 117.753 172.412 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.275 43.0 p 74.75 97.59 0.07 Allowed 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 127.216 2.206 . . . . 0.0 112.402 176.683 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.276 37.3 mm 75.12 -49.98 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.387 0 C-N-CA 125.464 1.506 . . . . 0.0 115.014 174.775 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.258 0.5 OUTLIER -76.9 -121.82 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.143 0 CA-C-N 122.551 2.432 . . . . 0.0 112.965 -179.223 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 82.9 p -159.72 102.09 1.5 Allowed 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 123.943 3.065 . . . . 0.0 117.167 179.964 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 tt -164.39 105.76 0.87 Allowed 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 102.802 -3.036 . . . . 0.0 102.802 173.307 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.6 m -121.13 122.7 40.58 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.865 0.84 . . . . 0.0 112.313 -173.666 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -138.22 136.38 36.52 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 123.94 0.896 . . . . 0.0 110.627 -174.312 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 67.1 m -61.5 146.26 49.18 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 119.906 -1.746 . . . . 0.0 114.839 -177.48 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -142.74 169.58 17.3 Favored 'General case' 0 CA--C 1.567 1.601 0 CA-C-O 123.663 1.697 . . . . 0.0 115.028 -174.514 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.43 ' H ' HD23 ' A' ' 41' ' ' LEU . 2.5 pt? -91.07 167.9 12.03 Favored 'General case' 0 CA--C 1.573 1.835 0 CA-C-N 114.329 -1.305 . . . . 0.0 111.459 173.89 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.9 158.5 25.08 Favored 'General case' 0 CA--C 1.584 2.27 0 O-C-N 120.344 -1.472 . . . . 0.0 113.467 174.492 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.49 166.94 22.68 Favored 'General case' 0 CA--C 1.572 1.822 0 O-C-N 120.236 -1.54 . . . . 0.0 113.161 177.868 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -96.54 163.11 13.17 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.553 -1.342 . . . . 0.0 112.895 -174.408 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -63.89 129.08 38.62 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.337 0.589 . . . . 0.0 111.083 177.364 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 79.81 14.95 0.9 Allowed 'General case' 0 N--CA 1.509 2.477 0 C-N-CA 125.069 1.348 . . . . 0.0 113.758 -171.991 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 27.2 t -113.88 160.14 19.09 Favored 'General case' 0 CA--C 1.566 1.578 0 O-C-N 120.385 -1.447 . . . . 0.0 111.887 174.73 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 65.8 mt-10 -70.85 116.81 11.58 Favored 'General case' 0 CA--C 1.571 1.771 0 CA-C-O 122.925 1.345 . . . . 0.0 113.729 -175.69 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.446 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 15.5 p -124.04 160.5 27.55 Favored 'General case' 0 CA--C 1.568 1.644 0 CA-C-N 113.987 -1.461 . . . . 0.0 113.812 177.766 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.6 t -134.22 123.81 24.92 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 105.363 -2.088 . . . . 0.0 105.363 171.775 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.96 62.82 3.49 Favored 'General case' 0 CA--C 1.565 1.557 0 N-CA-C 115.915 1.821 . . . . 0.0 115.915 -173.96 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.13 141.62 25.38 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 118.742 2.867 . . . . 0.0 118.742 -172.485 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 64.8 p -141.74 147.87 38.09 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 123.396 1.57 . . . . 0.0 108.834 172.201 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -134.59 -124.25 0.16 Allowed 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 174.598 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -132.61 57.97 1.78 Allowed 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 173.476 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -169.93 -172.48 36.49 Favored Glycine 0 N--CA 1.487 2.037 0 N-CA-C 115.584 0.994 . . . . 0.0 115.584 -173.396 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.545 HG12 ' HB2' ' A' ' 30' ' ' HIS . 3.3 t -81.45 143.42 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 CA-C-O 122.233 1.016 . . . . 0.0 111.808 -172.569 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -119.33 139.89 51.22 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-O 121.909 0.862 . . . . 0.0 112.6 -173.36 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -74.64 -6.39 48.39 Favored 'General case' 0 CA--C 1.589 2.478 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 174.181 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.62 127.36 3.17 Favored 'General case' 0 CA--C 1.568 1.64 0 C-N-CA 127.302 2.241 . . . . 0.0 106.454 -174.292 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.0 m -68.29 133.57 91.33 Favored Pre-proline 0 CA--C 1.587 2.374 0 O-C-N 119.705 -1.872 . . . . 0.0 112.537 174.124 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -52.31 -0.72 0.06 OUTLIER 'Trans proline' 0 CA--C 1.57 2.279 1 N-CA-C 123.877 4.53 . . . . 0.0 123.877 -174.761 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 73.37 -40.34 0.46 Allowed 'General case' 0 N--CA 1.503 2.186 0 N-CA-C 119.019 2.97 . . . . 0.0 119.019 174.205 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.269 15.2 pt-20 -89.2 59.53 4.95 Favored 'General case' 0 CA--C 1.555 1.151 1 N-CA-C 125.568 5.396 . . . . 0.0 125.568 -172.118 . . . . . . . . 3 2 . 1 . 023 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.2 mtm105 -88.68 87.81 7.39 Favored 'General case' 0 N--CA 1.501 2.103 0 N-CA-C 104.959 -2.237 . . . . 0.0 104.959 168.001 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 78.8 25.25 60.65 Favored Glycine 0 CA--C 1.568 3.376 0 N-CA-C 116.705 1.442 . . . . 0.0 116.705 -170.943 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . 0.272 4.9 tt -142.13 -162.37 1.39 Allowed 'General case' 0 CA--C 1.581 2.143 0 C-N-CA 125.346 1.458 . . . . 0.0 109.576 -176.283 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -140.06 138.57 35.48 Favored 'General case' 0 CA--C 1.578 2.052 0 O-C-N 118.688 -2.507 . . . . 0.0 110.744 174.229 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 43.4 t -93.05 123.63 36.44 Favored 'General case' 0 CA--C 1.568 1.64 0 O-C-N 121.261 -0.899 . . . . 0.0 108.602 170.832 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 . . . . . 0 N--CA 1.497 1.881 0 O-C-N 120.138 -1.601 . . . . 0.0 110.378 179.433 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 . . . . . 0 N--CA 1.499 2.016 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -106.17 -165.04 22.99 Favored Glycine 0 N--CA 1.492 2.426 0 C-N-CA 123.572 0.605 . . . . 0.0 113.941 173.547 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 34.0 mm -121.56 142.79 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.251 0 CA-C-O 122.472 1.129 . . . . 0.0 110.429 178.94 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.446 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 82.8 m -67.91 118.09 10.66 Favored 'General case' 0 CA--C 1.57 1.714 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 174.033 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -142.64 139.62 31.32 Favored 'General case' 0 N--CA 1.483 1.175 0 O-C-N 120.548 -1.345 . . . . 0.0 107.879 173.853 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -94.41 70.6 3.7 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 123.949 1.833 . . . . 0.0 112.027 -175.9 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.5 m . . . . . 0 CA--C 1.569 1.691 0 CA-C-N 112.667 -2.061 . . . . 0.0 113.947 -175.265 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 . . . . . 0 CA--C 1.582 2.18 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 pp -128.44 169.22 14.56 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 116.022 1.86 . . . . 0.0 116.022 -174.759 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -75.0 169.77 17.34 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 115.702 1.741 . . . . 0.0 115.702 -173.026 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -75.08 153.36 38.39 Favored 'General case' 0 CA--C 1.575 1.931 0 CA-C-O 122.253 1.025 . . . . 0.0 112.452 176.921 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 92.43 23.29 26.95 Favored Glycine 0 N--CA 1.496 2.643 0 N-CA-C 116.706 1.442 . . . . 0.0 116.706 -173.066 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 -135.62 142.87 45.29 Favored 'General case' 0 CA--C 1.569 1.676 0 C-N-CA 124.773 1.229 . . . . 0.0 110.805 -177.917 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.4 tp -77.9 142.21 38.57 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -174.844 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.9 p -131.88 -178.58 4.95 Favored 'General case' 0 CA--C 1.575 1.936 0 CA-C-O 123.106 1.431 . . . . 0.0 114.601 -176.201 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.9 mt -107.79 -74.59 0.65 Allowed 'General case' 0 CA--C 1.574 1.902 0 N-CA-C 104.851 -2.277 . . . . 0.0 104.851 170.603 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -95.86 -168.59 1.79 Allowed 'General case' 0 CA--C 1.587 2.384 0 CA-C-N 119.986 1.266 . . . . 0.0 113.345 171.758 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.0 m -90.15 -9.47 48.15 Favored 'General case' 0 N--CA 1.507 2.425 0 N-CA-C 117.034 2.235 . . . . 0.0 117.034 174.291 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.73 10.35 2.26 Favored 'General case' 0 CA--C 1.577 2.005 0 N-CA-C 117.395 2.368 . . . . 0.0 117.395 175.24 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -94.2 -29.88 14.88 Favored 'General case' 0 CA--C 1.569 1.693 0 C-N-CA 124.807 1.243 . . . . 0.0 113.821 176.866 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . 0.259 80.4 m -81.99 -172.72 4.09 Favored 'General case' 0 CA--C 1.585 2.314 0 CA-C-N 121.866 2.121 . . . . 0.0 111.382 173.035 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -56.11 -69.87 0.13 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 119.345 -2.097 . . . . 0.0 116.646 -172.014 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.0 t -86.86 -72.51 0.5 Allowed 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 122.053 0.93 . . . . 0.0 111.443 174.315 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -172.17 63.96 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.937 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.63 -174.017 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 37.5 t -139.74 71.84 1.39 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 119.368 -2.082 . . . . 0.0 116.378 -173.731 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.3 t -98.03 123.86 42.25 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 170.637 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -103.23 120.3 40.48 Favored 'General case' 0 CA--C 1.573 1.835 0 CA-C-O 122.956 1.36 . . . . 0.0 114.053 -172.456 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.522 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.1 t60 -86.07 133.37 33.9 Favored 'General case' 0 CA--C 1.562 1.422 0 C-N-CA 125.322 1.449 . . . . 0.0 112.389 -177.482 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -82.69 59.04 4.53 Favored 'General case' 0 CA--C 1.58 2.119 0 O-C-N 120.63 -1.294 . . . . 0.0 114.39 173.935 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.256 6.0 t 48.38 88.55 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.316 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 175.857 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.3 4.2 mp 73.92 -57.57 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.633 0 C-N-CA 125.419 1.488 . . . . 0.0 111.325 -178.734 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.0 mt -62.29 114.28 3.38 Favored 'General case' 0 N--CA 1.496 1.873 0 CA-C-N 120.833 1.651 . . . . 0.0 109.572 173.809 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.0 p -85.46 50.04 1.88 Allowed 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 120.257 3.429 . . . . 0.0 120.257 -171.135 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.3 tt -92.37 85.92 5.53 Favored 'General case' 0 N--CA 1.498 1.955 0 N-CA-C 101.799 -3.408 . . . . 0.0 101.799 169.981 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.419 ' HB3' HG11 ' A' ' 57' ' ' VAL . 51.0 m -94.75 109.59 21.53 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 122.464 1.126 . . . . 0.0 112.889 -170.545 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 29.9 ttt85 -123.94 135.5 53.71 Favored 'General case' 0 CA--C 1.562 1.414 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.267 -175.357 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 95.1 m -65.65 145.15 56.39 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 123.779 1.752 . . . . 0.0 114.103 -179.695 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -138.09 -173.08 3.42 Favored 'General case' 0 CA--C 1.566 1.564 0 CA-C-N 113.535 -1.666 . . . . 0.0 112.887 -174.177 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 pp -80.62 151.51 28.99 Favored 'General case' 0 CA--C 1.572 1.791 0 CA-C-O 122.86 1.314 . . . . 0.0 113.506 175.395 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.1 pttt -80.94 143.27 32.74 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 123.616 0.766 . . . . 0.0 110.591 173.66 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.01 152.68 38.7 Favored 'General case' 0 CA--C 1.568 1.669 0 N-CA-C 118.108 2.633 . . . . 0.0 118.108 -171.995 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -102.7 170.23 8.14 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 113.141 -1.845 . . . . 0.0 112.683 -178.533 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -50.18 130.11 22.18 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 115.176 1.547 . . . . 0.0 115.176 -174.727 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 69.32 31.63 3.82 Favored 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -173.35 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 43.4 m -129.8 153.76 47.92 Favored 'General case' 0 CA--C 1.566 1.583 0 CA-C-O 122.763 1.268 . . . . 0.0 111.345 174.98 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -74.72 115.0 13.81 Favored 'General case' 0 CA--C 1.571 1.769 0 CA-C-O 123.462 1.601 . . . . 0.0 113.537 -176.579 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 13.7 p -111.18 152.75 26.69 Favored 'General case' 0 CA--C 1.562 1.439 0 CA-C-N 113.596 -1.638 . . . . 0.0 112.229 174.57 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.9 m -77.46 108.36 10.57 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.363 -1.461 . . . . 0.0 107.546 174.292 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.94 -54.43 7.24 Favored 'General case' 0 CA--C 1.564 1.497 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -172.557 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -93.28 138.32 31.76 Favored 'General case' 0 CA--C 1.565 1.531 0 CA-C-N 118.582 0.628 . . . . 0.0 109.508 173.641 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.8 p -110.34 142.32 42.15 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 123.441 1.591 . . . . 0.0 111.901 178.138 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.72 -144.03 0.3 Allowed 'General case' 0 CA--C 1.568 1.664 0 CA-C-N 113.203 -1.817 . . . . 0.0 108.902 174.115 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -121.21 75.38 1.16 Allowed 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 103.729 -2.693 . . . . 0.0 103.729 171.474 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 174.32 -162.35 32.66 Favored Glycine 0 N--CA 1.485 1.934 0 CA-C-O 122.908 1.282 . . . . 0.0 116.295 -174.549 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.522 HG12 ' HB2' ' A' ' 30' ' ' HIS . 18.6 t -79.29 145.51 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 CA-C-O 122.841 1.305 . . . . 0.0 111.336 -176.032 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -115.35 138.78 50.61 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.016 -173.845 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -66.06 -30.83 71.42 Favored 'General case' 0 CA--C 1.587 2.386 0 O-C-N 120.034 -1.667 . . . . 0.0 115.332 -176.164 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.5 mtmm -153.82 113.49 3.83 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 102.902 -2.999 . . . . 0.0 102.902 172.794 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 67.9 m -39.85 150.23 0.26 Allowed Pre-proline 0 CA--C 1.599 2.837 0 N-CA-C 119.919 3.303 . . . . 0.0 119.919 -173.521 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -69.1 58.46 1.24 Allowed 'Trans proline' 0 CA--C 1.579 2.765 0 N-CA-C 121.674 3.682 . . . . 0.0 121.674 -173.822 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 3.4 t 61.34 162.7 0.07 Allowed 'General case' 0 CA--C 1.582 2.201 0 N-CA-C 117.823 2.527 . . . . 0.0 117.823 174.182 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -75.63 160.37 30.17 Favored 'General case' 0 CA--C 1.574 1.888 0 N-CA-C 115.494 1.665 . . . . 0.0 115.494 178.881 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -63.23 120.35 11.37 Favored 'General case' 0 CA--C 1.572 1.818 0 CA-C-O 122.553 1.168 . . . . 0.0 113.073 -179.111 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.19 -28.26 15.91 Favored Glycine 0 N--CA 1.498 2.81 0 N-CA-C 116.846 1.498 . . . . 0.0 116.846 -173.219 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.4 mp -98.65 144.9 27.42 Favored 'General case' 0 CA--C 1.565 1.539 0 CA-C-O 122.412 1.101 . . . . 0.0 111.944 -179.128 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.78 153.59 18.64 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 122.083 0.944 . . . . 0.0 112.489 -178.708 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 5.1 t -92.77 96.52 10.2 Favored 'General case' 0 CA--C 1.57 1.719 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.825 174.717 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 . . . . . 0 CA--C 1.57 1.738 0 O-C-N 120.436 -1.415 . . . . 0.0 113.431 -173.966 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 . . . . . 0 CA--C 1.559 1.327 0 N-CA-C 115.528 1.677 . . . . 0.0 115.528 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -108.12 166.75 13.09 Favored Glycine 0 CA--C 1.548 2.154 0 CA-C-N 113.596 -1.638 . . . . 0.0 109.443 170.055 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 38.2 mm -102.37 135.59 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 120.23 -1.747 . . . . 0.0 109.322 179.019 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 28.6 m -62.98 119.52 9.6 Favored 'General case' 0 CA--C 1.572 1.791 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 174.235 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -139.58 153.63 47.43 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 122.452 1.12 . . . . 0.0 109.775 174.902 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -94.22 69.6 3.75 Favored 'General case' 0 N--CA 1.496 1.858 0 CA-C-O 124.02 1.867 . . . . 0.0 115.688 -172.272 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.4 t . . . . . 0 N--CA 1.502 2.14 0 CA-C-N 112.89 -1.959 . . . . 0.0 112.572 174.752 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 . . . . . 0 N--CA 1.505 2.281 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -122.11 151.18 41.2 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 123.866 1.794 . . . . 0.0 115.61 -179.214 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -83.0 166.46 18.79 Favored 'General case' 0 CA--C 1.572 1.819 0 CA-C-N 114.503 -1.226 . . . . 0.0 112.59 173.931 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.44 149.18 33.3 Favored 'General case' 0 CA--C 1.578 2.029 0 O-C-N 120.658 -1.276 . . . . 0.0 109.879 173.677 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.8 30.42 18.06 Favored Glycine 0 CA--C 1.559 2.84 0 O-C-N 121.236 -0.915 . . . . 0.0 114.979 -171.724 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -137.27 141.41 41.97 Favored 'General case' 0 CA--C 1.565 1.542 0 C-N-CA 125.024 1.33 . . . . 0.0 109.528 -174.024 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.7 tt -69.63 117.73 11.6 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.906 -1.121 . . . . 0.0 111.785 -179.054 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 39' ' ' CYS . 22.0 p -124.98 155.68 39.26 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 122.083 0.944 . . . . 0.0 113.222 -175.654 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.1 mp -91.4 -77.48 0.42 Allowed 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 173.841 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -92.38 164.9 13.32 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 115.504 1.668 . . . . 0.0 115.504 174.968 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.3 m -70.6 -22.78 62.51 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 116.474 2.028 . . . . 0.0 116.474 175.434 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.89 6.84 5.52 Favored 'General case' 0 CA--C 1.58 2.111 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 173.095 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -91.82 -41.49 10.62 Favored 'General case' 0 CA--C 1.565 1.527 0 C-N-CA 124.67 1.188 . . . . 0.0 111.899 174.148 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 74.4 m -77.41 136.77 38.43 Favored 'General case' 0 CA--C 1.571 1.787 0 CA-C-N 121.082 1.764 . . . . 0.0 110.476 174.05 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -44.58 -37.43 3.58 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 120.976 3.695 . . . . 0.0 120.976 -172.247 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.2 m -80.69 -83.26 0.11 Allowed 'General case' 0 CA--C 1.57 1.718 0 CA-C-N 118.472 0.578 . . . . 0.0 110.361 173.928 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -175.77 31.08 0.0 OUTLIER 'General case' 0 CA--C 1.588 2.431 0 C-N-CA 124.497 1.119 . . . . 0.0 113.138 -178.255 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 36.7 t -134.9 102.24 5.17 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 118.989 2.959 . . . . 0.0 118.989 -170.506 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 49.5 t -106.03 113.42 26.95 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 102.568 -3.123 . . . . 0.0 102.568 169.018 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.15 123.82 42.39 Favored 'General case' 0 CA--C 1.564 1.484 0 CA-C-O 122.059 0.933 . . . . 0.0 112.297 -173.065 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 20.4 t-80 -77.92 165.45 24.08 Favored 'General case' 0 CA--C 1.567 1.63 0 CA-C-O 122.656 1.217 . . . . 0.0 114.052 -174.742 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -80.35 -101.82 0.03 OUTLIER 'General case' 0 CA--C 1.577 2.006 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 172.631 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.1 p -150.77 90.93 1.67 Allowed 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 120.498 1.499 . . . . 0.0 108.112 174.148 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.271 5.9 mt 70.58 -31.6 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.512 2.67 0 N-CA-C 115.943 1.831 . . . . 0.0 115.943 174.603 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.4 tp -76.62 -123.31 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.151 0 CA-C-N 121.724 2.056 . . . . 0.0 111.03 174.938 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.0 p -162.05 92.82 0.86 Allowed 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 122.433 2.379 . . . . 0.0 114.986 178.11 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.0 tp -150.86 83.83 1.34 Allowed 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 104.067 -2.568 . . . . 0.0 104.067 172.746 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.8 m -104.5 131.34 51.99 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 122.646 1.213 . . . . 0.0 112.795 -173.29 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -131.71 134.82 46.32 Favored 'General case' 0 CA--C 1.562 1.419 0 C-N-CA 124.53 1.132 . . . . 0.0 108.951 -178.659 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 17' ' ' CYS . 99.4 m -65.26 146.92 54.32 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 119.874 -1.766 . . . . 0.0 113.9 178.409 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.42 179.73 6.49 Favored 'General case' 0 CA--C 1.564 1.513 0 CA-C-N 113.979 -1.464 . . . . 0.0 114.025 -173.368 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 98.1 mt -81.26 149.25 29.08 Favored 'General case' 0 CA--C 1.568 1.664 0 CA-C-O 122.097 0.951 . . . . 0.0 112.492 176.118 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -75.99 153.38 36.57 Favored 'General case' 0 CA--C 1.573 1.855 0 CA-C-O 121.856 0.836 . . . . 0.0 111.458 173.943 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.61 157.4 31.95 Favored 'General case' 0 CA--C 1.568 1.655 0 N-CA-C 116.856 2.169 . . . . 0.0 116.856 -173.252 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 43.2 mtp180 -117.58 172.03 7.62 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 113.257 -1.792 . . . . 0.0 111.308 179.45 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -48.59 132.46 17.33 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 116.216 1.932 . . . . 0.0 116.216 -172.972 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 m120 72.75 18.42 4.19 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -173.934 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.4 t -114.45 151.71 32.76 Favored 'General case' 0 CA--C 1.567 1.632 0 CA-C-O 123.11 1.433 . . . . 0.0 112.599 176.096 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -76.74 101.79 5.96 Favored 'General case' 0 CA--C 1.57 1.718 0 C-N-CA 124.86 1.264 . . . . 0.0 113.291 -177.706 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.468 ' SG ' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -99.05 156.52 16.89 Favored 'General case' 0 CA--C 1.564 1.493 0 CA-C-O 123.09 1.424 . . . . 0.0 113.793 177.254 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.1 t -82.46 96.9 8.15 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 171.522 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.6 -47.42 40.54 Favored 'General case' 0 CA--C 1.566 1.583 0 N-CA-C 115.926 1.825 . . . . 0.0 115.926 -173.304 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -89.03 153.12 21.26 Favored 'General case' 0 CA--C 1.57 1.746 0 C-N-CA 123.792 0.837 . . . . 0.0 109.547 172.904 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.1 p -126.27 146.74 49.88 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 123.946 1.831 . . . . 0.0 111.86 176.775 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -105.79 -53.0 2.72 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-N 112.869 -1.969 . . . . 0.0 113.355 175.144 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -164.76 -54.45 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.915 0 C-N-CA 127.14 2.176 . . . . 0.0 107.761 -174.875 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 112.01 94.36 2.19 Favored Glycine 0 N--CA 1.474 1.2 0 N-CA-C 116.916 1.526 . . . . 0.0 116.916 174.513 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.6 t -115.79 140.22 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 119.427 -2.219 . . . . 0.0 107.132 110.157 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -116.9 135.86 53.4 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -172.286 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -64.36 -41.48 96.71 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.616 -1.302 . . . . 0.0 113.377 174.23 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -142.2 110.59 6.05 Favored 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 103.549 -2.759 . . . . 0.0 103.549 172.503 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 57.1 m -53.02 161.5 1.22 Allowed Pre-proline 0 CA--C 1.588 2.427 0 N-CA-C 118.262 2.69 . . . . 0.0 118.262 -174.817 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.468 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 77.8 Cg_exo -53.86 172.34 0.27 Allowed 'Trans proline' 0 CA--C 1.573 2.436 0 C-N-CA 122.954 2.436 . . . . 0.0 117.984 174.917 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 63.0 m -71.5 147.33 47.86 Favored 'General case' 0 CA--C 1.569 1.703 0 O-C-N 120.849 -1.157 . . . . 0.0 113.388 174.998 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -65.46 153.12 42.27 Favored 'General case' 0 CA--C 1.572 1.825 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 179.006 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 38.7 ttp180 -40.42 -35.65 0.46 Allowed 'General case' 0 N--CA 1.507 2.411 0 N-CA-C 121.574 3.916 . . . . 0.0 121.574 -174.606 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.42 -25.06 74.98 Favored Glycine 0 CA--C 1.555 2.551 0 N-CA-C 119.985 2.754 . . . . 0.0 119.985 173.933 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -135.28 169.22 17.81 Favored 'General case' 0 CA--C 1.574 1.883 0 CA-C-N 120.21 2.005 . . . . 0.0 114.159 179.16 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -98.68 158.17 15.79 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 -173.707 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.7 t -94.86 128.3 41.51 Favored 'General case' 0 CA--C 1.57 1.723 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.046 171.451 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 . . . . . 0 N--CA 1.493 1.722 0 O-C-N 120.006 -1.684 . . . . 0.0 108.152 -178.126 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 116.405 2.002 . . . . 0.0 116.405 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -107.72 151.03 16.96 Favored Glycine 0 CA--C 1.548 2.125 0 CA-C-N 114.458 -1.246 . . . . 0.0 111.19 173.453 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 24.7 mm -92.52 134.91 29.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 120.099 -1.824 . . . . 0.0 110.583 -166.464 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 98.8 m -63.98 123.59 19.39 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 175.013 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -143.73 151.63 40.27 Favored 'General case' 0 CA--C 1.563 1.449 0 CA-C-O 123.612 1.672 . . . . 0.0 110.532 174.875 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -98.08 79.72 2.63 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 124.422 2.058 . . . . 0.0 111.26 -176.071 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.9 t . . . . . 0 CA--C 1.569 1.707 0 CA-C-N 112.012 -2.358 . . . . 0.0 108.056 -175.636 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 69.4 t . . . . . 0 CA--C 1.58 2.132 0 CA-C-O 115.737 -2.078 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.86 98.04 1.04 Allowed 'Trans proline' 0 CA--C 1.569 2.271 0 CA-C-N 125.698 3.071 . . . . 0.0 113.726 178.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . 0.25 3.1 p30 43.33 69.97 2.07 Favored Pre-proline 0 CA--C 1.588 2.423 0 N-CA-C 117.818 2.525 . . . . 0.0 117.818 -178.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -76.57 80.85 2.66 Favored 'Trans proline' 0 CA--C 1.572 2.406 0 C-N-CA 122.711 2.274 . . . . 0.0 113.791 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . 0.259 37.6 ttp180 69.19 -73.82 0.09 Allowed 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 125.919 1.687 . . . . 0.0 112.443 -174.397 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 64.62 23.84 69.13 Favored Glycine 0 N--CA 1.499 2.856 0 N-CA-C 121.489 3.356 . . . . 0.0 121.489 176.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 13.0 mt -96.13 -14.29 7.91 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.486 0 CA-C-N 118.416 1.108 . . . . 0.0 113.594 -173.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 58.8 mt -71.16 120.83 19.89 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.297 0 O-C-N 119.25 -2.156 . . . . 0.0 110.654 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.291 1.7 pt -100.44 -127.7 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.222 0 C-N-CA 122.875 0.47 . . . . 0.0 111.957 -174.142 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -140.33 81.4 1.81 Allowed 'General case' 0 CA--C 1.579 2.093 0 N-CA-C 116.96 2.207 . . . . 0.0 116.96 -173.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mt -132.42 152.51 51.46 Favored 'General case' 0 N--CA 1.5 2.068 0 CA-C-O 123.695 1.712 . . . . 0.0 113.269 173.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -83.81 163.51 20.1 Favored 'General case' 0 CA--C 1.571 1.752 0 CA-C-N 114.375 -1.284 . . . . 0.0 113.612 177.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.77 137.79 38.64 Favored 'General case' 0 CA--C 1.579 2.062 0 O-C-N 120.867 -1.146 . . . . 0.0 108.011 172.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.33 1.22 44.19 Favored Glycine 0 CA--C 1.56 2.889 0 N-CA-C 115.866 1.106 . . . . 0.0 115.866 -171.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -113.34 149.81 33.48 Favored 'General case' 0 CA--C 1.572 1.807 0 CA-C-N 118.951 1.375 . . . . 0.0 110.283 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.4 tt -69.45 128.12 35.42 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 120.824 -1.172 . . . . 0.0 112.87 -176.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.9 p -128.97 151.78 49.31 Favored 'General case' 0 CA--C 1.562 1.404 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -177.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.9 mt -85.84 -81.5 0.21 Allowed 'General case' 0 CA--C 1.567 1.6 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 173.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -94.53 177.76 5.82 Favored 'General case' 0 N--CA 1.499 1.981 0 CA-C-N 119.311 0.959 . . . . 0.0 112.57 173.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -71.0 -6.19 36.99 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 173.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.31 7.18 4.56 Favored 'General case' 0 CA--C 1.571 1.771 0 N-CA-C 117.128 2.27 . . . . 0.0 117.128 172.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -91.72 -51.2 5.35 Favored 'General case' 0 CA--C 1.567 1.607 0 C-N-CA 124.116 0.966 . . . . 0.0 111.97 -177.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 80.0 m -82.6 147.69 28.44 Favored 'General case' 0 CA--C 1.558 1.267 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -53.56 -53.7 47.98 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 124.039 0.936 . . . . 0.0 111.082 173.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 65.3 m -83.27 104.31 13.33 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 103.568 -2.753 . . . . 0.0 103.568 168.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.87 80.42 0.46 Allowed 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 124.998 2.332 . . . . 0.0 114.624 -172.743 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.0 t -142.54 72.97 1.39 Allowed 'General case' 0 CA--C 1.56 1.352 0 CA-C-N 112.291 -2.231 . . . . 0.0 110.076 -174.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 34.6 t -78.74 111.38 14.8 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 104.746 -2.316 . . . . 0.0 104.746 172.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -100.42 115.62 30.45 Favored 'General case' 0 CA--C 1.567 1.627 0 CA-C-O 122.997 1.38 . . . . 0.0 114.332 -170.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.605 ' HB2' HG12 ' A' ' 57' ' ' VAL . 15.5 t-80 -82.19 158.22 23.67 Favored 'General case' 0 CA--C 1.566 1.583 0 C-N-CA 126.047 1.739 . . . . 0.0 113.238 -178.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.3 -55.56 32.19 Favored 'General case' 0 CA--C 1.583 2.228 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 174.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.6 t 175.29 -38.88 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.518 0 C-N-CA 125.794 1.638 . . . . 0.0 111.838 -174.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 6.0 tp -157.28 -46.33 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.225 0 CA-C-N 119.95 1.25 . . . . 0.0 113.272 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.6 mt -77.07 -83.44 0.07 Allowed 'General case' 0 N--CA 1.497 1.888 0 CA-C-N 120.708 1.595 . . . . 0.0 112.91 -174.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 96.3 p -154.89 -123.65 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 121.332 1.878 . . . . 0.0 112.934 174.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.1 tt 53.96 80.72 0.11 Allowed 'General case' 0 N--CA 1.503 2.181 0 CA-C-N 120.325 1.42 . . . . 0.0 110.944 -173.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.5 m -117.06 107.65 14.78 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 122.947 1.356 . . . . 0.0 111.262 -174.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 20.7 ttp180 -125.93 141.37 52.01 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.682 1.193 . . . . 0.0 108.616 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 91.1 m -67.08 147.61 52.94 Favored 'General case' 0 CA--C 1.561 1.394 0 O-C-N 119.656 -1.903 . . . . 0.0 114.586 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.14 -177.82 5.18 Favored 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 113.262 -1.79 . . . . 0.0 112.303 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 35.5 tp -85.68 142.95 28.67 Favored 'General case' 0 CA--C 1.571 1.756 0 O-C-N 120.987 -1.071 . . . . 0.0 112.66 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -72.42 143.96 48.33 Favored 'General case' 0 CA--C 1.575 1.937 0 O-C-N 121.497 -0.752 . . . . 0.0 110.186 173.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.26 152.18 36.57 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 118.611 2.819 . . . . 0.0 118.611 -171.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.9 mmt180 -121.48 175.74 6.04 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-N 111.522 -2.581 . . . . 0.0 111.732 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -57.84 127.56 32.67 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -173.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 76.39 29.59 0.7 Allowed 'General case' 0 N--CA 1.504 2.268 0 C-N-CA 125.194 1.398 . . . . 0.0 113.593 -172.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.6 t -124.85 149.6 47.31 Favored 'General case' 0 CA--C 1.566 1.581 0 O-C-N 120.485 -1.385 . . . . 0.0 112.123 175.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -77.85 104.76 8.6 Favored 'General case' 0 CA--C 1.572 1.791 0 CA-C-O 123.533 1.635 . . . . 0.0 113.207 -177.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -101.22 167.58 10.11 Favored 'General case' 0 CA--C 1.575 1.911 0 C-N-CA 125.901 1.68 . . . . 0.0 111.794 173.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.0 t -86.51 -86.7 0.14 Allowed 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 104.984 -2.228 . . . . 0.0 104.984 170.023 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -156.34 -74.51 0.1 Allowed 'General case' 0 CA--C 1.565 1.557 0 CA-C-N 120.513 1.506 . . . . 0.0 112.606 172.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 23.3 p90 -137.58 177.53 7.8 Favored 'General case' 0 CA--C 1.574 1.875 0 C-N-CA 124.013 0.925 . . . . 0.0 111.548 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.1 p -87.89 135.22 33.49 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.599 -1.313 . . . . 0.0 113.634 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.588 HD12 ' H ' ' A' ' 55' ' ' TYR . 1.0 OUTLIER -100.98 -121.49 0.16 Allowed 'General case' 0 CA--C 1.566 1.563 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 172.533 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.588 ' H ' HD12 ' A' ' 54' ' ' LEU . 60.3 t80 -144.64 74.36 1.41 Allowed 'General case' 0 CA--C 1.57 1.732 0 N-CA-C 103.663 -2.717 . . . . 0.0 103.663 171.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 168.2 -171.57 42.54 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 116.217 1.247 . . . . 0.0 116.217 -174.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.605 HG12 ' HB2' ' A' ' 30' ' ' HIS . 4.4 t -77.65 142.29 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 CA-C-O 122.779 1.276 . . . . 0.0 111.103 -172.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -115.37 126.55 54.55 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.075 -172.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -59.61 -40.99 89.37 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 175.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -142.49 113.24 7.42 Favored 'General case' 0 CA--C 1.56 1.365 0 N-CA-C 102.891 -3.003 . . . . 0.0 102.891 171.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 59.0 m -52.02 144.14 21.61 Favored Pre-proline 0 CA--C 1.586 2.358 0 N-CA-C 115.796 1.776 . . . . 0.0 115.796 -177.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -68.26 179.62 2.81 Favored 'Trans proline' 0 CA--C 1.568 2.187 0 C-N-CA 122.284 1.989 . . . . 0.0 116.411 -174.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 56.7 m -74.06 149.03 41.4 Favored 'General case' 0 CA--C 1.573 1.84 0 O-C-N 121.029 -1.044 . . . . 0.0 112.682 174.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.51 176.51 2.85 Favored 'General case' 0 CA--C 1.583 2.233 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 177.25 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.4 113.66 4.26 Favored 'General case' 0 CA--C 1.579 2.062 0 O-C-N 119.866 -1.771 . . . . 0.0 112.983 178.275 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 122.49 -39.11 2.36 Favored Glycine 0 N--CA 1.497 2.737 0 CA-C-N 113.923 -1.49 . . . . 0.0 116.079 -173.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 mp -98.4 151.77 20.2 Favored 'General case' 0 CA--C 1.567 1.604 0 CA-C-O 122.732 1.253 . . . . 0.0 112.704 -177.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -111.23 151.83 27.82 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.158 -0.964 . . . . 0.0 111.407 -179.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 4.0 t -90.65 117.76 29.56 Favored 'General case' 0 CA--C 1.569 1.685 0 C-N-CA 122.827 0.451 . . . . 0.0 111.991 175.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -97.29 93.62 6.62 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.617 -1.302 . . . . 0.0 109.86 -176.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.21 75.32 0.02 OUTLIER Glycine 0 N--CA 1.497 2.707 0 N-CA-C 121.57 3.388 . . . . 0.0 121.57 -173.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -81.06 11.67 3.93 Favored 'General case' 0 CA--C 1.586 2.358 0 N-CA-C 117.055 2.243 . . . . 0.0 117.055 172.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . 0.269 47.5 tptt 73.54 -60.37 0.53 Allowed 'General case' 0 N--CA 1.5 2.062 0 C-N-CA 126.063 1.745 . . . . 0.0 112.421 -173.059 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 32.6 t 44.06 80.6 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 116.095 1.887 . . . . 0.0 116.095 174.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -74.91 53.17 0.58 Allowed 'General case' 0 CA--C 1.578 2.044 0 N-CA-C 117.212 2.301 . . . . 0.0 117.212 -173.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 92.1 t -88.27 77.35 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 CA-C-O 123.508 1.623 . . . . 0.0 106.634 173.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.06 -16.81 0.31 Allowed Glycine 0 CA--C 1.558 2.761 0 N-CA-C 116.867 1.507 . . . . 0.0 116.867 -173.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.1 m 78.3 -60.67 0.4 Allowed 'General case' 0 N--CA 1.503 2.205 0 C-N-CA 126.189 1.796 . . . . 0.0 115.647 176.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.7 tp -139.42 123.98 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 CA-C-O 123.488 1.613 . . . . 0.0 109.013 -178.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.523 HG23 ' H ' ' A' ' 82' ' ' THR . 6.8 t -146.22 175.76 10.26 Favored 'General case' 0 CA--C 1.576 1.943 0 CA-C-N 113.769 -1.56 . . . . 0.0 112.583 179.331 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -104.78 27.04 8.41 Favored 'General case' 0 CA--C 1.585 2.326 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 172.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.523 ' H ' HG23 ' A' ' 80' ' ' THR . 13.2 t -142.27 -170.21 3.12 Favored 'General case' 0 CA--C 1.577 1.999 0 CA-C-O 125.707 2.67 . . . . 0.0 110.965 -174.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -130.01 125.79 36.17 Favored 'General case' 0 CA--C 1.567 1.631 0 CA-C-N 111.639 -2.528 . . . . 0.0 106.181 173.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.437 ' CE2' HG21 ' A' ' 80' ' ' THR . 59.7 m-85 -99.22 153.23 19.09 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 123.3 1.524 . . . . 0.0 111.402 178.525 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -153.71 168.25 32.21 Favored Glycine 0 N--CA 1.48 1.59 0 CA-C-N 115.246 -0.888 . . . . 0.0 114.735 -175.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 23.8 mm -97.9 132.43 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.15 -1.206 . . . . 0.0 109.577 -176.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.2 m -67.12 125.83 27.25 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 174.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -143.23 158.95 43.17 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 123.105 1.431 . . . . 0.0 111.832 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -93.81 74.66 4.25 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 123.54 1.638 . . . . 0.0 111.511 -174.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.4 p -134.46 -28.49 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 CA-C-N 113.693 -1.594 . . . . 0.0 115.048 -176.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.16 68.68 1.56 Allowed Glycine 0 N--CA 1.494 2.555 0 N-CA-C 116.185 1.234 . . . . 0.0 116.185 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . 0.308 47.3 ptt85 58.56 -42.02 0.06 Allowed 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 118.795 2.887 . . . . 0.0 118.795 -174.027 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.7 m . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 123.54 1.638 . . . . 0.0 110.553 178.729 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 CA--C 1.582 2.18 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.25 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -80.92 81.75 2.65 Favored 'Trans proline' 0 CA--C 1.57 2.309 0 C-N-CA 122.55 2.167 . . . . 0.0 114.222 -178.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 78.94 92.16 0.05 OUTLIER Pre-proline 0 CA--C 1.581 2.148 0 C-N-CA 126.3 1.84 . . . . 0.0 111.412 -176.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -54.4 -43.08 62.05 Favored 'Trans proline' 0 CA--C 1.57 2.316 0 N-CA-C 118.757 2.561 . . . . 0.0 118.757 176.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -131.58 90.82 2.9 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 174.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -151.3 80.82 0.19 Allowed Glycine 0 N--CA 1.491 2.338 0 O-C-N 121.394 -0.816 . . . . 0.0 114.825 -178.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 65.3 mt -97.22 84.94 1.38 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.055 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 174.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.392 20.4 pt 55.46 -121.16 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 C-N-CA 125.476 1.511 . . . . 0.0 111.764 -174.162 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -124.46 173.34 10.62 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.95 0 CA-C-N 120.237 1.38 . . . . 0.0 111.55 176.624 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -144.1 94.25 2.55 Favored 'General case' 0 CA--C 1.576 1.973 0 N-CA-C 116.959 2.207 . . . . 0.0 116.959 -172.368 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.2 tp -159.39 125.15 4.29 Favored 'General case' 0 CA--C 1.579 2.091 0 N-CA-C 105.744 -1.947 . . . . 0.0 105.744 173.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -80.44 165.52 22.12 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 118.874 -2.391 . . . . 0.0 113.486 -175.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.17 144.01 44.99 Favored 'General case' 0 CA--C 1.576 1.974 0 O-C-N 120.962 -1.086 . . . . 0.0 110.037 174.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.79 25.06 26.1 Favored Glycine 0 CA--C 1.563 3.042 0 N-CA-C 114.769 0.668 . . . . 0.0 114.769 -171.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -136.15 148.4 48.18 Favored 'General case' 0 CA--C 1.571 1.762 0 C-N-CA 125.462 1.505 . . . . 0.0 109.132 -178.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 tt -69.1 117.75 11.14 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.59 -1.319 . . . . 0.0 112.284 -176.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 26.5 p -117.42 152.88 34.08 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 121.797 0.808 . . . . 0.0 113.054 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.0 mp -89.87 -78.72 0.36 Allowed 'General case' 0 CA--C 1.568 1.64 0 N-CA-C 106.348 -1.723 . . . . 0.0 106.348 172.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -96.46 168.86 10.29 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 120.59 1.541 . . . . 0.0 114.512 174.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.5 t -70.25 -21.93 62.93 Favored 'General case' 0 N--CA 1.506 2.355 0 N-CA-C 116.332 1.975 . . . . 0.0 116.332 174.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.17 16.74 0.54 Allowed 'General case' 0 CA--C 1.575 1.919 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 174.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 67.7 mt-30 -104.29 -39.66 6.4 Favored 'General case' 0 CA--C 1.572 1.813 0 C-N-CA 125.005 1.322 . . . . 0.0 113.177 173.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.0 m -80.7 149.04 29.9 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 115.54 1.682 . . . . 0.0 115.54 -177.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -57.02 -54.55 45.44 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.114 0.966 . . . . 0.0 110.544 172.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 91.9 p -82.42 101.28 10.54 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 103.766 -2.679 . . . . 0.0 103.766 168.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -69.39 80.47 0.38 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 125.267 2.46 . . . . 0.0 113.89 -172.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.2 t -156.93 82.41 0.94 Allowed 'General case' 0 CA--C 1.56 1.354 0 CA-C-N 112.096 -2.32 . . . . 0.0 110.729 -173.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 29.7 t -81.5 109.08 15.63 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 105.418 -2.068 . . . . 0.0 105.418 172.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.58 123.29 34.11 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-O 122.453 1.12 . . . . 0.0 112.726 -172.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.499 ' HB2' HG12 ' A' ' 57' ' ' VAL . 17.0 t60 -82.02 149.04 28.31 Favored 'General case' 0 CA--C 1.559 1.296 0 CA-C-O 122.707 1.241 . . . . 0.0 113.732 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -65.92 -1.26 2.84 Favored 'General case' 0 CA--C 1.585 2.317 0 N-CA-C 116.279 1.955 . . . . 0.0 116.279 171.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.266 64.9 p 68.84 85.75 0.14 Allowed 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 127.192 2.197 . . . . 0.0 110.384 -178.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.276 5.3 mp 77.41 140.78 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.587 2.379 0 C-N-CA 125.426 1.49 . . . . 0.0 109.364 -173.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.309 10.0 tp 84.94 -138.24 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.103 0 C-N-CA 126.455 1.902 . . . . 0.0 109.19 -174.423 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 96.4 p -165.3 96.61 0.69 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 121.445 1.929 . . . . 0.0 114.218 178.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 54.6 tp -150.35 89.25 1.56 Allowed 'General case' 0 CA--C 1.564 1.503 0 N-CA-C 103.925 -2.62 . . . . 0.0 103.925 173.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.8 m -104.51 132.85 50.28 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 122.832 1.301 . . . . 0.0 113.394 -172.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -136.93 133.56 35.82 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.528 1.131 . . . . 0.0 108.822 -177.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 55.2 m -66.57 146.46 54.48 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 124.341 2.019 . . . . 0.0 113.703 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -138.25 -178.08 5.12 Favored 'General case' 0 CA--C 1.564 1.483 0 CA-C-N 112.615 -2.084 . . . . 0.0 112.338 -174.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.5 tp -83.83 125.09 31.62 Favored 'General case' 0 CA--C 1.569 1.706 0 O-C-N 121.313 -0.867 . . . . 0.0 111.05 174.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -61.02 148.5 39.98 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 123.891 0.876 . . . . 0.0 112.508 174.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.21 152.53 42.17 Favored 'General case' 0 CA--C 1.564 1.517 0 N-CA-C 118.529 2.788 . . . . 0.0 118.529 -170.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.63 168.09 9.31 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 112.82 -1.991 . . . . 0.0 111.45 -174.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -51.59 139.42 20.57 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -178.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.354 10.9 p30 57.75 28.9 16.57 Favored 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -172.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.9 m -129.43 153.1 48.27 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-O 122.691 1.234 . . . . 0.0 110.55 174.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -69.5 137.27 52.4 Favored 'General case' 0 CA--C 1.578 2.044 0 CA-C-O 124.631 2.158 . . . . 0.0 115.354 -175.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 27.3 p -142.0 147.59 37.16 Favored 'General case' 0 CA--C 1.566 1.592 0 CA-C-N 112.241 -2.254 . . . . 0.0 110.691 -178.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 60.2 m -77.62 104.48 8.18 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 119.707 -1.871 . . . . 0.0 108.025 174.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.465 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . . . -78.85 43.93 0.52 Allowed 'General case' 0 CA--C 1.573 1.855 0 N-CA-C 118.732 2.864 . . . . 0.0 118.732 -173.607 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.9 p90 -164.29 138.01 5.3 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 126.096 1.758 . . . . 0.0 107.834 -174.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.5 p -114.21 137.68 51.46 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-O 122.883 1.325 . . . . 0.0 109.96 174.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.275 2.1 pp -96.22 -78.74 0.46 Allowed 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 113.821 -1.536 . . . . 0.0 108.48 176.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -159.84 -14.67 0.06 Allowed 'General case' 0 CA--C 1.587 2.378 0 C-N-CA 125.584 1.554 . . . . 0.0 112.757 176.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -164.59 -93.05 0.09 OUTLIER Glycine 0 N--CA 1.478 1.496 0 O-C-N 120.127 -1.608 . . . . 0.0 115.87 -174.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.499 HG12 ' HB2' ' A' ' 30' ' ' HIS . 1.9 t -79.28 143.94 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.191 0 CA-C-N 119.18 1.49 . . . . 0.0 112.243 -164.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -126.86 144.05 51.09 Favored 'General case' 0 CA--C 1.56 1.346 0 N-CA-C 114.96 1.466 . . . . 0.0 114.96 -172.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -69.65 -44.65 70.14 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.832 173.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -139.13 115.86 10.74 Favored 'General case' 0 CA--C 1.565 1.553 0 N-CA-C 102.783 -3.043 . . . . 0.0 102.783 173.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 58.2 m -53.5 145.71 27.16 Favored Pre-proline 0 CA--C 1.591 2.548 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 -174.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -79.0 65.57 8.85 Favored 'Trans proline' 0 CA--C 1.571 2.372 0 C-N-CA 123.498 2.799 . . . . 0.0 117.42 -173.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 58.1 m 58.97 165.17 0.05 OUTLIER 'General case' 0 CA--C 1.579 2.086 0 N-CA-C 117.048 2.24 . . . . 0.0 117.048 176.221 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -72.61 149.71 43.7 Favored 'General case' 0 CA--C 1.567 1.627 0 O-C-N 120.818 -1.176 . . . . 0.0 112.978 174.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.73 103.98 0.98 Allowed 'General case' 0 N--CA 1.499 2.003 0 CA-C-O 122.83 1.3 . . . . 0.0 112.368 -174.404 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 131.09 -32.01 3.07 Favored Glycine 0 CA--C 1.558 2.774 0 CA-C-N 114.344 -1.298 . . . . 0.0 114.58 -171.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mp -96.77 151.5 19.58 Favored 'General case' 0 CA--C 1.566 1.59 0 CA-C-O 122.77 1.271 . . . . 0.0 111.456 172.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -99.36 154.53 18.12 Favored 'General case' 0 CA--C 1.562 1.404 0 CA-C-O 122.291 1.043 . . . . 0.0 112.142 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.465 ' SG ' ' HB2' ' A' ' 51' ' ' ALA . 17.2 t -93.71 118.43 31.4 Favored 'General case' 0 CA--C 1.569 1.68 0 CA-C-N 115.327 -0.851 . . . . 0.0 108.79 172.229 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -96.88 99.01 10.58 Favored 'General case' 0 CA--C 1.57 1.732 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -172.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.07 124.87 3.11 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 117.491 1.756 . . . . 0.0 117.491 173.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -55.61 -45.55 77.47 Favored 'General case' 0 N--CA 1.504 2.233 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 172.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp 55.74 -103.25 0.17 Allowed 'General case' 0 N--CA 1.5 2.061 0 C-N-CA 125.597 1.559 . . . . 0.0 113.454 174.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.9 m 68.93 105.15 0.06 Allowed 'General case' 0 CA--C 1.567 1.633 0 C-N-CA 126.237 1.815 . . . . 0.0 113.407 174.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.9 mt -69.69 100.29 1.46 Allowed 'General case' 0 N--CA 1.49 1.552 0 CA-C-O 122.474 1.13 . . . . 0.0 110.813 176.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.2 p -71.56 69.38 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.586 2.363 0 CA-C-O 124.762 2.22 . . . . 0.0 112.83 175.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 157.72 54.09 0.01 OUTLIER Glycine 0 CA--C 1.552 2.394 0 CA-C-N 113.531 -1.668 . . . . 0.0 111.749 -174.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.5 m -171.64 140.66 1.37 Allowed 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 125.245 1.418 . . . . 0.0 108.215 -171.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 18.5 pt -78.96 -47.81 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 N-CA-C 117.384 2.364 . . . . 0.0 117.384 -173.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 80.3 p -133.63 -69.61 0.54 Allowed 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 117.108 2.262 . . . . 0.0 117.108 -172.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -84.61 87.89 7.3 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 103.297 -2.853 . . . . 0.0 103.297 172.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . 0.281 18.6 p -95.04 -92.58 0.2 Allowed 'General case' 0 CA--C 1.56 1.348 0 CA-C-N 114.435 -1.257 . . . . 0.0 109.349 -170.29 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -161.6 85.48 0.64 Allowed 'General case' 0 N--CA 1.495 1.792 0 CA-C-N 120.722 1.601 . . . . 0.0 108.649 173.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 99.5 m-85 -95.71 161.98 13.8 Favored 'General case' 0 CA--C 1.573 1.861 0 O-C-N 120.749 -1.22 . . . . 0.0 111.816 -174.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -55.96 154.11 14.81 Favored Glycine 0 N--CA 1.499 2.87 0 N-CA-C 117.712 1.845 . . . . 0.0 117.712 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 42.6 mm -99.8 137.13 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 O-C-N 120.668 -1.489 . . . . 0.0 110.804 -172.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 67.3 m -68.72 124.25 23.14 Favored 'General case' 0 CA--C 1.572 1.814 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 174.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 69.9 m-70 -141.47 163.11 33.82 Favored 'General case' 0 CA--C 1.565 1.539 0 O-C-N 120.628 -1.295 . . . . 0.0 111.048 178.007 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -95.82 85.45 4.11 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 123.483 1.611 . . . . 0.0 111.981 -175.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 48.0 t -126.42 77.65 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 CA-C-N 113.535 -1.666 . . . . 0.0 106.862 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -84.83 -60.02 1.92 Allowed Glycine 0 N--CA 1.495 2.627 0 N-CA-C 117.613 1.805 . . . . 0.0 117.613 -175.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 53.0 ttp180 -137.04 -67.77 0.49 Allowed 'General case' 0 N--CA 1.497 1.882 0 CA-C-N 117.864 0.832 . . . . 0.0 111.862 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.7 t . . . . . 0 N--CA 1.501 2.085 0 N-CA-C 115.667 1.729 . . . . 0.0 115.667 -178.598 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 88.4 t . . . . . 0 CA--C 1.578 2.051 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -84.62 59.54 5.72 Favored 'Trans proline' 0 CA--C 1.572 2.424 0 CA-C-N 122.733 2.012 . . . . 0.0 114.963 -178.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -162.52 126.34 1.9 Allowed Pre-proline 0 CA--C 1.578 2.029 0 O-C-N 120.928 -1.107 . . . . 0.0 110.192 -176.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -80.32 76.31 4.6 Favored 'Trans proline' 0 CA--C 1.572 2.422 0 CA-C-N 123.177 2.17 . . . . 0.0 114.424 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -135.0 91.61 2.77 Favored 'General case' 0 CA--C 1.565 1.53 0 CA-C-O 121.88 0.848 . . . . 0.0 109.77 -177.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.8 -51.86 37.75 Favored Glycine 0 N--CA 1.498 2.8 0 N-CA-C 118.017 1.967 . . . . 0.0 118.017 175.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . 0.307 6.6 tp 42.1 34.16 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.549 0 N-CA-C 120.005 3.335 . . . . 0.0 120.005 170.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 18.0 tt -95.33 116.39 36.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 119.955 -1.716 . . . . 0.0 111.418 -174.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.253 15.1 pt -105.36 -105.12 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.666 -0.646 . . . . 0.0 109.394 176.584 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.304 1.0 OUTLIER 54.18 53.16 11.42 Favored 'General case' 0 N--CA 1.507 2.39 0 N-CA-C 118.918 2.933 . . . . 0.0 118.918 174.949 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.1 mp -99.01 123.07 43.05 Favored 'General case' 0 CA--C 1.567 1.625 0 CA-C-O 122.778 1.275 . . . . 0.0 112.052 175.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -84.78 169.92 13.73 Favored 'General case' 0 CA--C 1.574 1.892 0 O-C-N 121.129 -0.982 . . . . 0.0 111.087 172.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.77 123.58 17.44 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.621 -1.3 . . . . 0.0 111.471 175.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 111.12 -6.2 28.83 Favored Glycine 0 CA--C 1.559 2.804 0 N-CA-C 117.157 1.623 . . . . 0.0 117.157 -172.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -99.09 135.73 40.08 Favored 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 119.635 1.718 . . . . 0.0 111.857 -178.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.6 tt -76.04 128.04 34.2 Favored 'General case' 0 CA--C 1.575 1.924 0 O-C-N 121.46 -0.775 . . . . 0.0 112.183 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.6 p -120.7 -171.78 2.25 Favored 'General case' 0 CA--C 1.577 1.998 0 CA-C-O 123.206 1.479 . . . . 0.0 114.702 -174.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.6 mt -112.29 -75.92 0.6 Allowed 'General case' 0 CA--C 1.578 2.025 0 N-CA-C 103.815 -2.661 . . . . 0.0 103.815 169.143 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.1 p30 -93.91 -177.67 4.41 Favored 'General case' 0 CA--C 1.589 2.47 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 172.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.0 m -84.95 -17.66 36.99 Favored 'General case' 0 N--CA 1.508 2.428 0 N-CA-C 116.289 1.959 . . . . 0.0 116.289 173.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.25 7.4 2.82 Favored 'General case' 0 CA--C 1.583 2.241 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 173.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -94.4 -40.78 9.75 Favored 'General case' 0 CA--C 1.568 1.66 0 C-N-CA 126.17 1.788 . . . . 0.0 110.862 173.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.7 m -76.24 117.18 17.66 Favored 'General case' 0 CA--C 1.566 1.586 0 CA-C-N 119.449 1.022 . . . . 0.0 109.604 173.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -77.63 9.56 3.3 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 118.007 2.595 . . . . 0.0 118.007 -174.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 65.0 p -81.15 -88.32 0.08 Allowed 'General case' 0 CA--C 1.581 2.152 0 N-CA-C 104.346 -2.464 . . . . 0.0 104.346 169.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -171.41 25.71 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.167 0 C-N-CA 125.996 1.718 . . . . 0.0 111.056 171.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 5.9 t -161.51 120.57 2.46 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 119.003 2.964 . . . . 0.0 119.003 -170.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 35.4 t -103.4 119.99 39.94 Favored 'General case' 0 CA--C 1.56 1.352 0 N-CA-C 102.651 -3.092 . . . . 0.0 102.651 167.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -93.31 115.37 27.95 Favored 'General case' 0 CA--C 1.562 1.425 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 -172.191 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.639 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.9 t-160 -84.04 114.6 21.85 Favored 'General case' 0 CA--C 1.567 1.596 0 C-N-CA 124.55 1.14 . . . . 0.0 112.228 -178.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -82.78 89.75 6.82 Favored 'General case' 0 CA--C 1.571 1.768 0 O-C-N 119.927 -1.733 . . . . 0.0 111.439 174.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.305 5.6 t 52.6 -177.0 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -176.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 28.5 mm -57.65 -28.78 32.91 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.607 0 O-C-N 118.937 -2.352 . . . . 0.0 114.812 -179.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.6 mt -51.98 -21.91 3.5 Favored 'General case' 0 N--CA 1.503 2.177 0 N-CA-C 118.544 2.794 . . . . 0.0 118.544 174.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.406 39.2 p 100.19 -122.65 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 127.67 2.388 . . . . 0.0 112.187 174.578 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 31.0 tp 45.48 76.84 0.09 Allowed 'General case' 0 N--CA 1.504 2.233 0 CA-C-N 120.426 1.466 . . . . 0.0 112.978 -173.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 48.6 m -98.14 108.23 20.89 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-O 122.023 0.916 . . . . 0.0 112.51 -172.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 34.2 ttm105 -118.17 136.55 53.56 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 124.091 0.956 . . . . 0.0 110.331 -176.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 62.6 m -62.92 154.21 31.01 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 117.59 2.441 . . . . 0.0 117.59 -174.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.95 -175.8 4.36 Favored 'General case' 0 CA--C 1.572 1.791 0 CA-C-N 112.713 -2.04 . . . . 0.0 112.443 -177.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.8 tp -116.88 171.88 7.61 Favored 'General case' 0 CA--C 1.572 1.821 0 O-C-N 121.204 -0.935 . . . . 0.0 110.929 176.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -56.32 145.35 27.27 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.814 -1.179 . . . . 0.0 113.706 174.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.1 149.62 35.7 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-O 123.928 1.823 . . . . 0.0 115.267 -174.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 44.4 mtp180 -107.68 169.19 8.74 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-N 112.715 -2.039 . . . . 0.0 111.731 -178.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -51.18 125.52 14.19 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -174.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 77.84 7.76 2.6 Favored 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -173.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.0 t -102.46 157.25 17.05 Favored 'General case' 0 CA--C 1.564 1.498 0 CA-C-O 123.104 1.431 . . . . 0.0 112.472 174.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -76.96 107.11 9.07 Favored 'General case' 0 CA--C 1.567 1.629 0 CA-C-O 123.218 1.485 . . . . 0.0 114.477 -173.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 23.1 p -114.96 147.61 39.81 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 113.373 -1.739 . . . . 0.0 113.237 176.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.0 t -104.8 130.82 52.83 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 170.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.85 -39.11 66.79 Favored 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 176.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -95.01 160.13 14.71 Favored 'General case' 0 CA--C 1.574 1.871 0 C-N-CA 125.541 1.536 . . . . 0.0 110.18 172.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 35.7 p -128.98 152.32 48.72 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-O 123.592 1.663 . . . . 0.0 110.434 173.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -97.38 -59.35 1.8 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 114.133 -1.394 . . . . 0.0 112.187 175.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -164.68 -52.31 0.03 OUTLIER 'General case' 0 CA--C 1.572 1.804 0 C-N-CA 126.195 1.798 . . . . 0.0 109.476 -176.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 100.69 102.4 2.52 Favored Glycine 0 CA--C 1.542 1.756 0 CA-C-O 122.754 1.197 . . . . 0.0 114.749 -177.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.639 HG12 ' HB2' ' A' ' 30' ' ' HIS . 13.8 t -103.58 141.33 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.123 0 O-C-N 118.09 -3.006 . . . . 0.0 107.704 83.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -113.4 133.91 54.92 Favored 'General case' 0 CA--C 1.553 1.058 0 N-CA-C 116.691 2.108 . . . . 0.0 116.691 -171.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -85.3 6.1 27.71 Favored 'General case' 0 CA--C 1.595 2.694 0 CA-C-N 115.04 -0.982 . . . . 0.0 113.482 169.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.85 102.95 0.79 Allowed 'General case' 0 CA--C 1.57 1.745 0 C-N-CA 127.563 2.345 . . . . 0.0 107.104 -171.391 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 95.6 m -67.56 131.95 92.92 Favored Pre-proline 0 CA--C 1.581 2.161 0 O-C-N 118.827 -2.42 . . . . 0.0 113.216 175.105 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -48.95 152.1 4.99 Favored 'Trans proline' 0 CA--C 1.569 2.227 0 C-N-CA 122.949 2.433 . . . . 0.0 116.68 175.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 1.8 t -74.25 150.68 40.14 Favored 'General case' 0 CA--C 1.572 1.826 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -173.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -67.76 162.38 24.0 Favored 'General case' 0 CA--C 1.574 1.886 0 N-CA-C 115.872 1.804 . . . . 0.0 115.872 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -64.25 119.05 9.54 Favored 'General case' 0 CA--C 1.572 1.808 0 O-C-N 120.735 -1.228 . . . . 0.0 111.754 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.91 -32.2 6.72 Favored Glycine 0 N--CA 1.494 2.56 0 CA-C-N 114.687 -1.142 . . . . 0.0 115.738 -172.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.6 mp -99.4 143.19 29.94 Favored 'General case' 0 CA--C 1.563 1.473 0 CA-C-O 122.798 1.285 . . . . 0.0 111.251 176.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.7 150.13 21.53 Favored 'General case' 0 CA--C 1.561 1.37 0 CA-C-O 122.449 1.118 . . . . 0.0 111.428 179.033 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 7.7 t -97.06 114.84 26.52 Favored 'General case' 0 CA--C 1.567 1.606 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.579 173.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -95.93 98.88 10.74 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.476 -1.39 . . . . 0.0 109.835 177.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -74.76 57.19 2.6 Favored Glycine 0 N--CA 1.498 2.815 0 N-CA-C 120.42 2.928 . . . . 0.0 120.42 -174.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.78 81.97 1.65 Allowed 'General case' 0 CA--C 1.572 1.817 0 C-N-CA 123.849 0.859 . . . . 0.0 111.043 175.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 71.7 tttt 64.69 -31.49 0.13 Allowed 'General case' 0 N--CA 1.509 2.488 0 N-CA-C 119.619 3.192 . . . . 0.0 119.619 175.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 27.6 p 70.91 43.72 0.66 Allowed 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 126.367 1.867 . . . . 0.0 115.783 -174.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 54.72 78.22 0.18 Allowed 'General case' 0 N--CA 1.503 2.222 0 C-N-CA 124.74 1.216 . . . . 0.0 112.733 -177.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . 0.339 0.9 OUTLIER 53.39 -1.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.504 0 N-CA-C 120.182 3.401 . . . . 0.0 120.182 -174.949 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.49 80.16 0.85 Allowed Glycine 0 N--CA 1.488 2.146 0 CA-C-N 120.572 1.533 . . . . 0.0 115.874 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.9 t -64.99 -9.92 25.44 Favored 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 119.176 3.028 . . . . 0.0 119.176 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.4 mp -121.69 -67.74 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.576 1.969 0 N-CA-C 104.75 -2.315 . . . . 0.0 104.75 173.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 36.7 p -129.77 168.21 16.89 Favored 'General case' 0 CA--C 1.573 1.846 0 C-N-CA 124.765 1.226 . . . . 0.0 108.734 171.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -132.82 94.92 3.47 Favored 'General case' 0 CA--C 1.563 1.473 0 O-C-N 120.142 -1.599 . . . . 0.0 111.915 -173.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 72.8 p -122.42 -94.22 0.5 Allowed 'General case' 0 N--CA 1.501 2.111 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 173.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -143.29 80.79 1.69 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.462 -1.399 . . . . 0.0 108.367 173.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -101.9 -178.6 3.76 Favored 'General case' 0 CA--C 1.572 1.812 0 CA-C-O 121.772 0.796 . . . . 0.0 111.866 -176.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -141.84 -174.79 14.8 Favored Glycine 0 N--CA 1.493 2.466 0 O-C-N 119.778 -1.826 . . . . 0.0 116.822 176.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.6 mm -126.49 142.95 41.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 CA-C-O 122.101 0.953 . . . . 0.0 110.081 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 8.0 m -73.83 127.77 33.73 Favored 'General case' 0 CA--C 1.569 1.71 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 173.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 72.3 m-70 -140.52 155.86 46.5 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.824 -1.172 . . . . 0.0 109.623 174.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -92.41 81.14 4.89 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 119.528 -1.982 . . . . 0.0 113.064 -173.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 72.5 t -115.34 -41.6 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 CA-C-N 112.685 -2.052 . . . . 0.0 112.865 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -66.01 -40.24 95.14 Favored Glycine 0 N--CA 1.497 2.714 0 N-CA-C 120.116 2.806 . . . . 0.0 120.116 -178.282 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 30.5 ttm105 70.41 -57.96 0.56 Allowed 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.494 1.728 0 CA-C-O 124.181 1.943 . . . . 0.0 115.102 -176.412 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 CA--C 1.579 2.069 0 CA-C-O 118.644 -0.693 . . . . 0.0 110.259 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -79.79 88.61 1.41 Allowed 'Trans proline' 0 CA--C 1.571 2.353 0 C-N-CA 122.434 2.089 . . . . 0.0 113.917 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -105.67 113.28 64.2 Favored Pre-proline 0 CA--C 1.576 1.962 0 CA-C-O 118.04 -0.981 . . . . 0.0 112.106 -175.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -68.19 19.97 0.13 Allowed 'Trans proline' 0 CA--C 1.582 2.898 0 N-CA-C 120.171 3.104 . . . . 0.0 120.171 174.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 27.1 ttt180 -141.5 117.27 10.4 Favored 'General case' 0 CA--C 1.564 1.5 0 C-N-CA 124.919 1.287 . . . . 0.0 107.778 178.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.07 -107.58 0.47 Allowed Glycine 0 N--CA 1.488 2.123 0 O-C-N 121.668 -0.645 . . . . 0.0 113.8 174.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 45.9 mm -93.54 -53.84 7.98 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 C-N-CA 122.738 0.415 . . . . 0.0 112.01 -175.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.2 pt -82.38 72.23 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 CA-C-N 119.811 1.187 . . . . 0.0 113.406 -174.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.25 32.3 pt -118.86 -139.2 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.577 1.991 0 C-N-CA 123.709 0.804 . . . . 0.0 108.968 175.259 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 58.46 62.39 1.98 Allowed 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 116.135 1.902 . . . . 0.0 116.135 176.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 36.7 tp -115.15 123.5 49.09 Favored 'General case' 0 CA--C 1.576 1.964 0 O-C-N 120.578 -1.327 . . . . 0.0 111.649 -177.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -66.1 162.81 18.83 Favored 'General case' 0 CA--C 1.576 1.976 0 O-C-N 119.757 -1.84 . . . . 0.0 115.624 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.31 130.38 44.24 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-O 121.928 0.87 . . . . 0.0 111.123 174.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 116.74 -13.8 14.8 Favored Glycine 0 CA--C 1.557 2.711 0 N-CA-C 116.844 1.498 . . . . 0.0 116.844 -172.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -103.98 151.15 23.54 Favored 'General case' 0 CA--C 1.567 1.627 0 CA-C-N 119.123 1.461 . . . . 0.0 112.716 -176.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.0 tt -73.33 123.43 23.76 Favored 'General case' 0 CA--C 1.574 1.888 0 O-C-N 121.308 -0.87 . . . . 0.0 112.095 -178.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.4 p -123.57 155.13 38.22 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 -176.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 mp -89.22 -76.67 0.4 Allowed 'General case' 0 CA--C 1.568 1.666 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 174.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -95.68 170.06 9.59 Favored 'General case' 0 CA--C 1.576 1.965 0 N-CA-C 114.414 1.264 . . . . 0.0 114.414 173.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 66.8 m -76.87 -21.58 54.74 Favored 'General case' 0 N--CA 1.507 2.381 0 N-CA-C 117.244 2.313 . . . . 0.0 117.244 176.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.79 7.26 3.23 Favored 'General case' 0 CA--C 1.583 2.229 0 N-CA-C 116.813 2.153 . . . . 0.0 116.813 174.234 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -96.2 -24.88 16.04 Favored 'General case' 0 CA--C 1.57 1.716 0 N-CA-C 115.662 1.727 . . . . 0.0 115.662 176.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 18.6 m -78.27 171.69 14.69 Favored 'General case' 0 CA--C 1.58 2.131 0 CA-C-N 121.029 1.74 . . . . 0.0 114.161 177.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -68.41 -65.37 0.71 Allowed 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.516 -1.365 . . . . 0.0 108.234 172.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 57.7 m -83.28 109.36 17.19 Favored 'General case' 0 CA--C 1.565 1.537 0 N-CA-C 101.157 -3.645 . . . . 0.0 101.157 168.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -67.66 82.36 0.18 Allowed 'General case' 0 N--CA 1.503 2.201 0 CA-C-O 125.158 2.409 . . . . 0.0 114.833 -171.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.8 t -145.25 77.39 1.52 Allowed 'General case' 0 CA--C 1.562 1.415 0 CA-C-N 111.549 -2.569 . . . . 0.0 112.482 -172.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.9 t -79.38 117.41 20.34 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 103.862 -2.644 . . . . 0.0 103.862 171.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.39 111.18 23.49 Favored 'General case' 0 CA--C 1.566 1.588 0 CA-C-O 123.256 1.503 . . . . 0.0 114.726 -169.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.517 ' HB2' HG12 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -85.56 172.1 11.21 Favored 'General case' 0 CA--C 1.572 1.803 0 C-N-CA 126.514 1.926 . . . . 0.0 111.82 174.744 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -76.1 -62.91 1.44 Allowed 'General case' 0 CA--C 1.588 2.407 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 169.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.6 p -147.26 -92.45 0.09 Allowed 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 102.329 -3.211 . . . . 0.0 102.329 172.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 92.3 mt -119.07 -12.13 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.567 0 CA-C-N 121.661 2.028 . . . . 0.0 113.318 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.9 tp -127.3 94.71 4.07 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 122.652 2.478 . . . . 0.0 112.214 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.7 p -172.43 164.7 5.71 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 124.473 1.109 . . . . 0.0 112.949 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 15.6 tp -75.56 121.45 22.42 Favored 'General case' 0 CA--C 1.574 1.892 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 171.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.4 m -95.69 138.89 32.71 Favored 'General case' 0 CA--C 1.569 1.693 0 O-C-N 121.246 -0.909 . . . . 0.0 113.304 -172.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 18.5 ttp180 -132.64 144.07 50.09 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.377 -0.827 . . . . 0.0 111.831 -175.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 71.6 m -63.76 138.4 58.47 Favored 'General case' 0 CA--C 1.566 1.574 0 O-C-N 119.676 -1.89 . . . . 0.0 113.302 175.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -138.88 -172.14 3.25 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-N 113.937 -1.483 . . . . 0.0 113.243 -173.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.5 mt -89.2 151.14 22.33 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-O 122.261 1.029 . . . . 0.0 112.74 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.15 152.66 36.64 Favored 'General case' 0 CA--C 1.572 1.825 0 O-C-N 121.619 -0.676 . . . . 0.0 112.525 173.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.476 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . . . -79.93 171.14 15.51 Favored 'General case' 0 CA--C 1.573 1.833 0 CA-C-O 123.435 1.588 . . . . 0.0 114.186 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -118.83 164.97 14.62 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 122.897 1.332 . . . . 0.0 112.304 -174.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -61.24 137.77 58.23 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.299 -0.875 . . . . 0.0 113.209 178.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 64.58 26.37 13.27 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -173.096 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 52.4 m -123.01 149.62 44.09 Favored 'General case' 0 CA--C 1.561 1.378 0 CA-C-O 122.929 1.347 . . . . 0.0 110.186 174.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -75.63 102.13 5.22 Favored 'General case' 0 CA--C 1.576 1.945 0 CA-C-O 124.213 1.959 . . . . 0.0 114.131 -176.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.446 ' SG ' ' HA ' ' A' ' 62' ' ' PRO . 4.4 t -95.29 149.61 21.16 Favored 'General case' 0 CA--C 1.565 1.543 0 CA-C-O 124.066 1.889 . . . . 0.0 111.122 173.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.7 p -93.33 113.01 25.09 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 114.405 -1.27 . . . . 0.0 108.307 174.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.4 -8.32 59.02 Favored 'General case' 0 CA--C 1.563 1.462 0 N-CA-C 117.426 2.38 . . . . 0.0 117.426 -175.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . 0.334 0.2 OUTLIER -94.65 176.12 6.4 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 117.383 2.364 . . . . 0.0 117.383 -174.513 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.4 m 79.04 -147.08 0.02 OUTLIER 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 100.793 -3.78 . . . . 0.0 100.793 -167.074 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 54' ' ' LEU 0.596 2.8 mm? -177.98 -77.0 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.025 0 O-C-N 116.991 -3.568 . . . . 0.0 110.583 162.243 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -77.87 -20.31 53.25 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.91 -1.119 . . . . 0.0 112.607 171.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -90.0 -152.42 26.87 Favored Glycine 0 CA--C 1.55 2.242 0 CA-C-O 123.338 1.521 . . . . 0.0 112.507 172.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.517 HG12 ' HB2' ' A' ' 30' ' ' HIS . 10.0 t -84.62 139.41 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 CA-C-O 123.026 1.394 . . . . 0.0 114.038 -165.42 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -105.65 156.16 18.54 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -174.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -90.91 -68.07 0.81 Allowed 'General case' 0 N--CA 1.503 2.215 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 -175.042 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -116.91 96.03 5.28 Favored 'General case' 0 CA--C 1.567 1.616 0 N-CA-C 101.747 -3.427 . . . . 0.0 101.747 170.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 66.9 m -39.03 149.86 0.23 Allowed Pre-proline 0 CA--C 1.578 2.03 0 N-CA-C 120.547 3.536 . . . . 0.0 120.547 -173.117 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.446 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 78.8 Cg_endo -65.63 170.9 10.41 Favored 'Trans proline' 0 CA--C 1.568 2.197 0 C-N-CA 122.223 1.949 . . . . 0.0 114.552 174.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.476 ' SG ' ' HB3' ' A' ' 43' ' ' ALA . 95.3 m -88.76 178.37 6.48 Favored 'General case' 0 CA--C 1.571 1.758 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 -174.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -61.55 174.53 0.75 Allowed 'General case' 0 CA--C 1.579 2.092 0 N-CA-C 117.494 2.405 . . . . 0.0 117.494 -174.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 24.6 tpt180 -61.02 111.63 1.76 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.124 -1.61 . . . . 0.0 113.136 -175.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 96.79 -19.74 53.49 Favored Glycine 0 N--CA 1.499 2.88 0 N-CA-C 116.892 1.517 . . . . 0.0 116.892 -172.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.94 120.35 38.17 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 124.804 1.242 . . . . 0.0 108.603 176.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.81 164.31 12.62 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 115.532 1.679 . . . . 0.0 115.532 -172.567 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 14.4 t -91.8 104.41 16.86 Favored 'General case' 0 CA--C 1.566 1.559 0 CA-C-N 113.306 -1.77 . . . . 0.0 107.32 171.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -91.78 99.2 12.12 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-N 121.525 1.966 . . . . 0.0 107.533 -177.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -72.32 64.87 1.34 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 117.283 1.673 . . . . 0.0 117.283 -175.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -53.33 -48.95 68.05 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 124.903 1.281 . . . . 0.0 114.423 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 46.6 tttt -111.93 0.73 16.18 Favored 'General case' 0 CA--C 1.587 2.395 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 172.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.0 m -85.03 60.86 6.51 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 119.728 -1.857 . . . . 0.0 112.47 174.096 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.3 tt -160.1 -58.37 0.06 Allowed 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 124.6 1.16 . . . . 0.0 109.323 -174.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 10.7 p -76.59 77.19 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.578 2.044 0 CA-C-O 123.377 1.56 . . . . 0.0 112.121 175.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -155.81 -59.61 0.01 OUTLIER Glycine 0 N--CA 1.493 2.439 0 N-CA-C 116.641 1.416 . . . . 0.0 116.641 -176.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 63.2 m 59.64 24.57 13.41 Favored 'General case' 0 N--CA 1.509 2.475 0 N-CA-C 118.548 2.795 . . . . 0.0 118.548 178.146 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.493 HG23 ' H ' ' A' ' 80' ' ' THR 0.309 9.7 tp -145.46 -103.16 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 120.28 -1.513 . . . . 0.0 107.404 175.468 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.493 ' H ' HG23 ' A' ' 79' ' ' ILE . 9.6 p -101.41 128.11 47.75 Favored 'General case' 0 N--CA 1.498 1.965 0 CA-C-N 120.887 1.676 . . . . 0.0 109.631 174.356 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -87.45 79.52 8.37 Favored 'General case' 0 CA--C 1.568 1.661 0 CA-C-O 122.768 1.271 . . . . 0.0 113.344 -174.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 24.6 p -96.52 -19.36 19.16 Favored 'General case' 0 N--CA 1.51 2.539 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 173.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -77.1 106.01 8.54 Favored 'General case' 0 CA--C 1.57 1.716 0 C-N-CA 124.608 1.163 . . . . 0.0 108.35 173.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -98.66 168.63 10.03 Favored 'General case' 0 CA--C 1.574 1.876 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -172.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -126.92 171.7 18.53 Favored Glycine 0 N--CA 1.494 2.507 0 O-C-N 120.915 -1.116 . . . . 0.0 114.397 175.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.6 mm -96.96 139.99 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.246 0 O-C-N 119.883 -1.951 . . . . 0.0 112.118 -168.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 3.8 m -74.3 131.92 41.61 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.249 -1.532 . . . . 0.0 114.39 173.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 64.7 m-70 -140.59 158.62 43.72 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 122.531 1.158 . . . . 0.0 110.98 177.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -95.94 130.21 42.98 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 120.964 -1.085 . . . . 0.0 111.623 -176.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.6 p -143.83 -50.02 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.886 0 N-CA-C 114.719 1.377 . . . . 0.0 114.719 -173.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -102.21 63.51 0.48 Allowed Glycine 0 N--CA 1.496 2.678 0 O-C-N 120.796 -1.19 . . . . 0.0 115.895 178.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 22.4 tpp85 -101.04 106.38 17.66 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-N 117.616 0.708 . . . . 0.0 112.004 -174.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.5 t . . . . . 0 N--CA 1.501 2.102 0 N-CA-C 116.604 2.075 . . . . 0.0 116.604 175.453 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 28.3 m . . . . . 0 CA--C 1.584 2.263 0 CA-C-O 114.524 -2.655 . . . . 0.0 116.903 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -81.36 77.52 3.94 Favored 'Trans proline' 0 CA--C 1.571 2.37 0 CA-C-N 127.713 3.79 . . . . 0.0 115.108 -174.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.6 t70 53.62 66.91 4.06 Favored Pre-proline 0 CA--C 1.591 2.555 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -78.03 159.4 30.53 Favored 'Trans proline' 0 CA--C 1.57 2.301 0 C-N-CA 122.531 2.154 . . . . 0.0 114.597 174.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.4 tpt180 -82.19 69.65 8.96 Favored 'General case' 0 N--CA 1.5 2.042 0 CA-C-O 123.542 1.639 . . . . 0.0 112.88 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.35 44.22 0.16 Allowed Glycine 0 N--CA 1.492 2.402 0 CA-C-N 114.419 -1.264 . . . . 0.0 115.256 177.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 10.3 tp -87.4 75.02 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.57 1.743 0 CA-C-O 122.818 1.294 . . . . 0.0 110.709 -175.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.255 24.0 mm 78.42 -52.17 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.612 0 C-N-CA 125.073 1.349 . . . . 0.0 111.364 -174.232 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 29.9 pt -98.79 175.96 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.579 2.095 0 CA-C-N 119.307 0.958 . . . . 0.0 111.432 175.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 84.73 82.51 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 126.65 1.98 . . . . 0.0 111.028 -174.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.73 139.9 51.99 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 123.363 1.554 . . . . 0.0 114.61 -176.385 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.5 156.88 30.71 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 122.241 1.02 . . . . 0.0 113.138 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -80.9 119.7 23.78 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 122.716 1.246 . . . . 0.0 109.02 -175.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 129.64 -20.61 5.16 Favored Glycine 0 CA--C 1.558 2.769 0 CA-C-N 114.222 -1.354 . . . . 0.0 114.692 -171.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.284 6.0 tp10 -99.62 158.85 15.47 Favored 'General case' 0 CA--C 1.572 1.802 0 CA-C-N 119.436 1.618 . . . . 0.0 112.036 -178.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.8 tp -75.37 135.44 40.81 Favored 'General case' 0 CA--C 1.578 2.028 0 O-C-N 120.963 -1.085 . . . . 0.0 113.714 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.9 p -133.85 159.74 39.75 Favored 'General case' 0 CA--C 1.564 1.514 0 C-N-CA 124.871 1.268 . . . . 0.0 112.361 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.7 mt -92.48 -77.14 0.44 Allowed 'General case' 0 CA--C 1.566 1.59 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 173.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.3 p30 -91.24 167.38 12.36 Favored 'General case' 0 CA--C 1.58 2.117 0 N-CA-C 115.43 1.641 . . . . 0.0 115.43 174.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.2 m -70.51 -20.79 62.81 Favored 'General case' 0 N--CA 1.509 2.52 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 174.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.96 4.45 5.37 Favored 'General case' 0 CA--C 1.579 2.088 0 N-CA-C 116.909 2.188 . . . . 0.0 116.909 174.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -94.83 -31.48 13.7 Favored 'General case' 0 CA--C 1.565 1.522 0 C-N-CA 125.082 1.353 . . . . 0.0 114.371 174.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 11.2 m -78.17 157.59 29.34 Favored 'General case' 0 CA--C 1.574 1.881 0 CA-C-N 121.703 2.047 . . . . 0.0 114.18 177.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -61.97 -57.07 13.1 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.753 -1.217 . . . . 0.0 109.506 172.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.7 m -83.82 110.6 18.48 Favored 'General case' 0 CA--C 1.567 1.597 0 N-CA-C 102.737 -3.06 . . . . 0.0 102.737 169.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -66.27 82.47 0.09 Allowed 'General case' 0 N--CA 1.502 2.141 0 CA-C-O 124.187 1.946 . . . . 0.0 114.153 -172.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.6 t -154.03 82.75 1.14 Allowed 'General case' 0 CA--C 1.567 1.611 0 CA-C-N 112.843 -1.98 . . . . 0.0 112.956 -173.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.9 t -85.6 111.86 20.44 Favored 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 104.231 -2.507 . . . . 0.0 104.231 171.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.15 123.06 43.16 Favored 'General case' 0 CA--C 1.561 1.388 0 CA-C-O 122.443 1.116 . . . . 0.0 112.841 -171.355 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -79.82 129.5 34.53 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.111 0.964 . . . . 0.0 112.404 -173.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -76.41 43.57 0.31 Allowed 'General case' 0 CA--C 1.583 2.218 0 N-CA-C 116.414 2.005 . . . . 0.0 116.414 174.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 43.7 p 61.03 88.28 0.09 Allowed 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 125.769 1.628 . . . . 0.0 114.306 174.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 23.6 mm 75.11 -57.19 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.613 0 C-N-CA 125.138 1.375 . . . . 0.0 113.264 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -42.67 -44.98 4.52 Favored 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 118.361 2.726 . . . . 0.0 118.361 -177.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.338 28.6 p 96.47 -4.91 0.07 Allowed 'General case' 0 N--CA 1.507 2.408 0 N-CA-C 118.81 2.893 . . . . 0.0 118.81 173.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 mp -74.61 95.35 2.8 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 121.926 2.148 . . . . 0.0 106.609 172.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.8 m -97.64 134.07 41.33 Favored 'General case' 0 CA--C 1.559 1.317 0 CA-C-N 114.661 -1.154 . . . . 0.0 113.67 -170.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 68.3 ttp85 -114.24 144.57 43.0 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.224 1.01 . . . . 0.0 111.687 -176.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 75.1 m -69.4 132.5 46.46 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 119.92 -1.737 . . . . 0.0 111.096 173.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.27 178.92 7.08 Favored 'General case' 0 CA--C 1.568 1.643 0 N-CA-C 115.151 1.537 . . . . 0.0 115.151 -173.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.571 HD13 ' H ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -86.82 160.29 18.81 Favored 'General case' 0 CA--C 1.573 1.842 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 178.054 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.59 156.63 25.08 Favored 'General case' 0 CA--C 1.582 2.173 0 CA-C-O 121.923 0.868 . . . . 0.0 112.533 175.238 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.01 166.21 21.79 Favored 'General case' 0 CA--C 1.572 1.819 0 N-CA-C 116.588 2.07 . . . . 0.0 116.588 -175.244 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 13.4 mtp-105 -131.33 171.39 13.41 Favored 'General case' 0 CA--C 1.564 1.519 0 CA-C-N 113.961 -1.472 . . . . 0.0 111.555 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -45.98 129.79 9.71 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 116.682 2.105 . . . . 0.0 116.682 -174.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 73.04 10.1 5.31 Favored 'General case' 0 N--CA 1.505 2.298 0 N-CA-C 115.623 1.712 . . . . 0.0 115.623 -174.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.0 t -107.92 159.49 16.49 Favored 'General case' 0 CA--C 1.567 1.607 0 CA-C-O 122.969 1.366 . . . . 0.0 111.286 174.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -71.39 128.4 35.73 Favored 'General case' 0 CA--C 1.563 1.466 0 CA-C-O 123.164 1.459 . . . . 0.0 114.006 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -122.37 128.53 51.09 Favored 'General case' 0 CA--C 1.561 1.387 0 CA-C-N 113.304 -1.771 . . . . 0.0 108.974 173.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.3 t -86.7 97.49 10.61 Favored 'General case' 0 CA--C 1.558 1.253 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.555 173.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.413 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . . . -78.52 76.63 5.02 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 123.616 1.674 . . . . 0.0 112.159 -176.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -144.67 153.74 42.06 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 117.419 2.378 . . . . 0.0 117.419 -171.443 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.1 p -149.25 135.96 19.54 Favored 'General case' 0 CA--C 1.558 1.267 0 CA-C-O 124.265 1.983 . . . . 0.0 106.3 169.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.287 1.9 pp -141.35 -80.11 0.25 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 112.982 -1.917 . . . . 0.0 105.917 -176.551 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -150.84 -1.42 0.37 Allowed 'General case' 0 CA--C 1.591 2.522 0 C-N-CA 126.409 1.883 . . . . 0.0 110.759 172.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 170.97 -83.71 0.08 OUTLIER Glycine 0 C--N 1.351 1.391 0 O-C-N 119.046 -2.284 . . . . 0.0 117.686 -173.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 2.4 t -78.39 137.05 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 CA-C-N 119.758 1.779 . . . . 0.0 113.035 -157.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -123.96 130.5 52.69 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.109 -1.405 . . . . 0.0 110.458 -173.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -62.54 -43.73 98.09 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -178.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.6 mptt -139.33 106.87 5.57 Favored 'General case' 0 CA--C 1.562 1.434 0 N-CA-C 103.519 -2.771 . . . . 0.0 103.519 173.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.0 m -49.65 147.78 5.82 Favored Pre-proline 0 CA--C 1.591 2.525 0 N-CA-C 117.058 2.244 . . . . 0.0 117.058 -174.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -60.75 172.35 2.92 Favored 'Trans proline' 0 CA--C 1.569 2.231 0 C-N-CA 122.877 2.385 . . . . 0.0 118.003 -173.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 35.3 m -73.0 161.69 30.39 Favored 'General case' 0 CA--C 1.573 1.833 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -174.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -62.53 156.73 22.2 Favored 'General case' 0 CA--C 1.577 2.007 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -61.73 109.45 1.22 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.745 -1.222 . . . . 0.0 113.495 -174.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.86 -24.82 18.35 Favored Glycine 0 N--CA 1.5 2.923 0 N-CA-C 116.502 1.361 . . . . 0.0 116.502 -172.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 tt -98.28 136.7 38.09 Favored 'General case' 0 CA--C 1.574 1.877 0 C-N-CA 124.897 1.279 . . . . 0.0 109.034 176.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.89 159.01 15.2 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 116.855 2.169 . . . . 0.0 116.855 -172.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.413 ' SG ' ' HB2' ' A' ' 51' ' ' ALA . 9.1 t -95.55 132.43 40.68 Favored 'General case' 0 CA--C 1.573 1.849 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.329 171.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.298 2.8 pp20? -95.0 -158.91 0.68 Allowed 'General case' 0 N--CA 1.506 2.339 0 CA-C-N 122.096 2.226 . . . . 0.0 112.169 177.032 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -132.57 83.54 0.3 Allowed Glycine 0 N--CA 1.492 2.416 0 O-C-N 119.372 -2.08 . . . . 0.0 117.612 -173.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 47.0 m-20 -87.16 96.61 10.37 Favored 'General case' 0 CA--C 1.567 1.634 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 168.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -71.35 132.28 44.62 Favored 'General case' 0 CA--C 1.571 1.786 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 -174.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.1 t -72.07 -51.51 21.29 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 174.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.6 tt 69.93 -66.22 0.28 Allowed 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 125.947 1.699 . . . . 0.0 114.883 173.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.2 p -79.03 -47.59 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 N-CA-C 115.528 1.677 . . . . 0.0 115.528 -176.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.5 95.43 1.2 Allowed Glycine 0 N--CA 1.488 2.102 0 N-CA-C 116.329 1.292 . . . . 0.0 116.329 178.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 97.6 p -77.69 84.1 4.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.539 -0.977 . . . . 0.0 109.119 165.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.428 0.2 OUTLIER 64.19 -50.91 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.537 0 C-N-CA 126.406 1.882 . . . . 0.0 113.471 -171.632 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.255 54.4 m -121.43 172.96 7.68 Favored 'General case' 0 CA--C 1.582 2.208 0 C-N-CA 126.276 1.831 . . . . 0.0 109.333 173.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -78.98 74.73 5.5 Favored 'General case' 0 CA--C 1.579 2.06 0 O-C-N 119.631 -1.918 . . . . 0.0 110.527 174.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 56.4 p -110.03 72.94 0.81 Allowed 'General case' 0 N--CA 1.502 2.142 0 CA-C-O 125.005 2.336 . . . . 0.0 114.527 -173.291 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -161.88 115.92 1.89 Allowed 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 111.058 -2.792 . . . . 0.0 104.148 172.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -130.97 163.92 26.48 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 122.097 0.951 . . . . 0.0 112.822 -173.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.42 162.17 41.12 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 118.608 2.203 . . . . 0.0 118.608 175.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 19.6 mm -98.43 148.3 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.003 0 CA-C-O 122.587 1.184 . . . . 0.0 109.459 176.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.8 m -72.66 125.3 27.15 Favored 'General case' 0 CA--C 1.571 1.765 0 O-C-N 120.397 -1.439 . . . . 0.0 113.153 173.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 70.7 m-70 -140.51 152.29 45.46 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 120.245 -1.534 . . . . 0.0 111.573 176.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -96.94 122.57 40.06 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-O 122.102 0.953 . . . . 0.0 109.674 177.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 46.0 t -82.92 -34.77 11.72 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -174.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -166.29 -82.92 0.05 OUTLIER Glycine 0 N--CA 1.488 2.116 0 O-C-N 121.079 -1.013 . . . . 0.0 113.518 175.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 31.5 tpt180 -135.78 -73.9 0.45 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 117.138 0.469 . . . . 0.0 111.066 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.8 m . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 124.44 2.067 . . . . 0.0 113.44 -175.137 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 31.1 m . . . . . 0 CA--C 1.584 2.262 0 CA-C-O 114.374 -2.726 . . . . 0.0 116.504 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -70.5 77.79 1.31 Allowed 'Trans proline' 0 CA--C 1.575 2.543 0 CA-C-N 127.37 3.668 . . . . 0.0 117.302 -177.037 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . 0.267 18.1 t70 -92.63 -64.63 0.14 Allowed Pre-proline 0 CA--C 1.581 2.152 0 CA-C-O 115.922 -1.989 . . . . 0.0 111.17 176.253 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -76.51 97.7 1.15 Allowed 'Trans proline' 0 CA--C 1.571 2.337 0 CA-C-N 125.382 2.958 . . . . 0.0 111.21 173.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.7 mmm180 -85.26 69.29 10.72 Favored 'General case' 0 CA--C 1.572 1.798 0 N-CA-C 115.185 1.55 . . . . 0.0 115.185 -173.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -171.95 -101.19 0.14 Allowed Glycine 0 N--CA 1.483 1.806 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 174.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . 0.266 11.0 tp -137.86 -64.27 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.578 2.04 0 C-N-CA 124.254 1.022 . . . . 0.0 110.066 175.085 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.258 18.0 tt -134.46 -67.43 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 N-CA-C 102.728 -3.064 . . . . 0.0 102.728 172.1 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.259 29.5 pt -108.76 -146.8 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.586 2.359 0 N-CA-C 106.116 -1.809 . . . . 0.0 106.116 170.221 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 57.97 80.08 0.18 Allowed 'General case' 0 CA--C 1.582 2.204 0 N-CA-C 116.374 1.99 . . . . 0.0 116.374 176.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -149.68 146.05 27.04 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 123.34 1.543 . . . . 0.0 113.249 173.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -84.82 171.64 12.09 Favored 'General case' 0 CA--C 1.569 1.709 0 N-CA-C 114.071 1.138 . . . . 0.0 114.071 -178.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.21 127.51 31.62 Favored 'General case' 0 CA--C 1.575 1.906 0 O-C-N 121.14 -0.975 . . . . 0.0 111.466 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 117.41 -20.74 11.06 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 117.061 1.584 . . . . 0.0 117.061 -173.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -101.87 153.44 19.84 Favored 'General case' 0 CA--C 1.575 1.912 0 CA-C-N 119.064 1.432 . . . . 0.0 112.319 -179.134 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 tt -74.55 129.66 38.16 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.075 -1.016 . . . . 0.0 113.464 -174.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.6 p -127.02 151.24 48.86 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 124.272 1.029 . . . . 0.0 112.955 178.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.8 mp -87.79 -71.78 0.56 Allowed 'General case' 0 CA--C 1.57 1.719 0 O-C-N 120.946 -1.096 . . . . 0.0 108.46 173.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -95.25 173.48 7.53 Favored 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 120.531 1.514 . . . . 0.0 114.563 173.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.3 m -77.98 -19.1 55.11 Favored 'General case' 0 N--CA 1.505 2.282 0 N-CA-C 117.204 2.298 . . . . 0.0 117.204 176.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.91 10.69 2.64 Favored 'General case' 0 CA--C 1.58 2.131 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 172.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -94.41 -46.66 6.92 Favored 'General case' 0 CA--C 1.558 1.287 0 CA-C-O 117.67 -1.157 . . . . 0.0 113.071 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.9 m -65.87 149.24 50.51 Favored 'General case' 0 CA--C 1.576 1.959 0 CA-C-N 122.076 2.216 . . . . 0.0 113.685 178.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.0 mmmp? -59.37 -53.61 56.17 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 120.621 -1.3 . . . . 0.0 110.536 172.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 87.6 p -82.96 100.0 10.15 Favored 'General case' 0 CA--C 1.572 1.817 0 N-CA-C 102.179 -3.267 . . . . 0.0 102.179 167.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 51.6 m-80 -67.64 85.46 0.19 Allowed 'General case' 0 N--CA 1.501 2.12 0 CA-C-O 125.238 2.447 . . . . 0.0 114.611 -170.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 t -152.31 77.77 1.2 Allowed 'General case' 0 CA--C 1.562 1.424 0 CA-C-N 111.216 -2.72 . . . . 0.0 110.725 -173.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.3 t -82.1 111.16 17.98 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 172.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.52 130.28 46.57 Favored 'General case' 0 CA--C 1.556 1.193 0 CA-C-O 122.145 0.974 . . . . 0.0 111.338 -172.642 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -79.42 173.34 12.68 Favored 'General case' 0 CA--C 1.568 1.638 0 N-CA-C 114.894 1.442 . . . . 0.0 114.894 -173.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 44.6 p-10 -80.46 -63.98 1.29 Allowed 'General case' 0 CA--C 1.568 1.673 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 173.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.5 m -160.8 -83.76 0.04 OUTLIER 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 104.479 -2.415 . . . . 0.0 104.479 171.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 69.4 mt -123.53 -22.45 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.302 0 CA-C-N 120.116 1.325 . . . . 0.0 112.805 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.9 tp -76.89 -113.94 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 122.467 2.394 . . . . 0.0 111.642 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 95.3 p -161.05 101.67 1.26 Allowed 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 122.733 2.515 . . . . 0.0 115.571 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.8 tp -163.79 86.36 0.49 Allowed 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 103.821 -2.659 . . . . 0.0 103.821 172.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 11.8 m -105.77 129.56 53.94 Favored 'General case' 0 CA--C 1.566 1.576 0 CA-C-O 122.532 1.158 . . . . 0.0 112.712 -172.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 19.2 ttp180 -132.49 146.59 52.05 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.368 1.067 . . . . 0.0 110.655 -175.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 73.2 m -67.98 142.32 56.0 Favored 'General case' 0 CA--C 1.563 1.475 0 O-C-N 119.821 -1.799 . . . . 0.0 113.598 176.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.83 -173.81 3.81 Favored 'General case' 0 CA--C 1.569 1.693 0 CA-C-N 114.202 -1.363 . . . . 0.0 113.664 -174.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.9 mt -92.29 154.37 18.64 Favored 'General case' 0 CA--C 1.57 1.736 0 CA-C-O 122.47 1.128 . . . . 0.0 112.732 176.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.85 150.63 34.16 Favored 'General case' 0 CA--C 1.575 1.909 0 C-N-CA 123.648 0.779 . . . . 0.0 112.387 173.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.67 158.63 29.62 Favored 'General case' 0 CA--C 1.568 1.653 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 -173.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -115.23 168.59 9.82 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 113.464 -1.698 . . . . 0.0 111.414 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -53.55 130.16 35.02 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -174.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 72.05 27.91 2.6 Favored 'General case' 0 N--CA 1.506 2.338 0 C-N-CA 124.875 1.27 . . . . 0.0 114.101 -173.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.8 m -125.08 150.03 47.23 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.658 -1.277 . . . . 0.0 110.345 174.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -71.68 131.19 42.81 Favored 'General case' 0 CA--C 1.57 1.74 0 CA-C-O 122.941 1.353 . . . . 0.0 112.452 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.416 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 25.0 p -134.14 160.74 36.89 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-N 113.74 -1.573 . . . . 0.0 114.995 -174.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.1 m -79.38 101.94 8.41 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.892 0.854 . . . . 0.0 109.672 176.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -76.86 -47.56 20.93 Favored 'General case' 0 CA--C 1.571 1.783 0 N-CA-C 115.751 1.76 . . . . 0.0 115.751 -174.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -102.7 104.84 15.2 Favored 'General case' 0 CA--C 1.568 1.635 0 C-N-CA 124.599 1.16 . . . . 0.0 108.057 174.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.3 p -98.55 134.29 41.72 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 123.559 1.647 . . . . 0.0 113.799 -174.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -98.58 -170.83 2.01 Favored 'General case' 0 CA--C 1.578 2.031 0 CA-C-N 112.462 -2.153 . . . . 0.0 108.939 172.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -99.58 62.23 1.2 Allowed 'General case' 0 N--CA 1.501 2.119 0 CA-C-O 123.518 1.628 . . . . 0.0 108.38 174.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -169.49 -168.79 31.95 Favored Glycine 0 N--CA 1.475 1.275 0 CA-C-O 123.593 1.663 . . . . 0.0 114.149 -173.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.1 t -78.78 147.68 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 CA-C-O 123.215 1.483 . . . . 0.0 112.619 -163.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -117.09 138.34 51.69 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-N 114.313 -1.312 . . . . 0.0 113.396 -173.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -68.36 -33.16 73.77 Favored 'General case' 0 CA--C 1.589 2.479 0 O-C-N 121.256 -0.902 . . . . 0.0 112.697 172.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.56 109.65 3.72 Favored 'General case' 0 CA--C 1.566 1.59 0 N-CA-C 105.324 -2.102 . . . . 0.0 105.324 177.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 59.2 m -52.17 157.05 2.42 Favored Pre-proline 0 CA--C 1.591 2.551 0 N-CA-C 118.78 2.881 . . . . 0.0 118.78 -174.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -54.14 167.18 1.29 Allowed 'Trans proline' 0 CA--C 1.566 2.094 0 C-N-CA 123.374 2.716 . . . . 0.0 118.032 176.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.416 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 69.3 m -71.43 162.2 29.83 Favored 'General case' 0 CA--C 1.574 1.884 0 N-CA-C 115.028 1.492 . . . . 0.0 115.028 177.429 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -62.62 161.18 12.61 Favored 'General case' 0 CA--C 1.576 1.966 0 N-CA-C 115.624 1.712 . . . . 0.0 115.624 177.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 72.3 ttt180 -62.0 116.88 5.28 Favored 'General case' 0 CA--C 1.572 1.792 0 O-C-N 120.697 -1.252 . . . . 0.0 112.888 -175.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.29 -21.44 41.33 Favored Glycine 0 CA--C 1.559 2.842 0 N-CA-C 117.101 1.6 . . . . 0.0 117.101 -172.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 tp -99.78 141.27 32.8 Favored 'General case' 0 CA--C 1.572 1.814 0 C-N-CA 124.803 1.241 . . . . 0.0 111.545 -179.173 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -99.11 151.27 21.16 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.409 -1.432 . . . . 0.0 113.945 -174.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 13.1 t -95.41 99.12 11.08 Favored 'General case' 0 CA--C 1.57 1.715 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.49 172.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -97.17 116.6 29.67 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.483 -1.386 . . . . 0.0 110.38 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -140.37 153.58 23.58 Favored Glycine 0 N--CA 1.475 1.263 0 CA-C-O 124.756 2.309 . . . . 0.0 114.317 -174.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -122.0 -61.68 1.47 Allowed 'General case' 0 CA--C 1.567 1.613 0 CA-C-N 112.079 -2.061 . . . . 0.0 111.487 176.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -147.72 161.45 41.18 Favored 'General case' 0 CA--C 1.573 1.852 0 CA-C-N 120.045 1.293 . . . . 0.0 111.093 -174.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 85.4 p -85.97 -44.66 12.17 Favored 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 173.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -133.44 -73.94 0.49 Allowed 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 119.657 1.117 . . . . 0.0 110.571 -178.2 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.538 HG13 ' H ' ' A' ' 77' ' ' GLY 0.3 14.9 p -109.56 -91.5 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 CA-C-N 119.358 0.981 . . . . 0.0 111.656 -176.341 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.538 ' H ' HG13 ' A' ' 76' ' ' VAL . . . -152.61 77.98 0.21 Allowed Glycine 0 N--CA 1.491 2.308 0 O-C-N 121.062 -1.024 . . . . 0.0 114.149 -177.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.1 m -158.96 139.26 12.27 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 124.082 0.953 . . . . 0.0 109.721 175.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 11.8 pt -74.74 -93.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.728 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 26.8 p 62.45 -171.75 0.16 Allowed 'General case' 0 N--CA 1.509 2.497 0 CA-C-N 122.259 2.3 . . . . 0.0 113.538 174.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -64.7 -16.69 63.25 Favored 'General case' 0 CA--C 1.59 2.502 0 O-C-N 120.207 -1.558 . . . . 0.0 114.897 171.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 6.7 t -114.06 84.14 1.99 Allowed 'General case' 0 CA--C 1.567 1.599 0 CA-C-O 125.316 2.484 . . . . 0.0 111.355 177.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -134.3 93.24 3.04 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 111.74 -2.482 . . . . 0.0 105.536 174.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.0 m-30 -99.39 164.53 12.07 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 116.216 1.932 . . . . 0.0 116.216 -170.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -146.17 174.55 26.04 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 115.902 1.121 . . . . 0.0 115.902 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.8 mm -111.39 143.27 21.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 CA-C-O 122.17 0.986 . . . . 0.0 109.865 -177.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.413 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 69.4 m -71.04 120.61 16.85 Favored 'General case' 0 CA--C 1.569 1.701 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 174.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 71.8 m-70 -142.02 161.07 38.91 Favored 'General case' 0 CA--C 1.565 1.55 0 CA-C-O 123.349 1.547 . . . . 0.0 111.751 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -97.66 102.36 14.1 Favored 'General case' 0 CA--C 1.563 1.466 0 O-C-N 120.932 -1.105 . . . . 0.0 110.732 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 41.4 t -125.25 73.48 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 CA-C-O 122.354 1.074 . . . . 0.0 108.635 -175.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -88.79 29.79 5.7 Favored Glycine 0 N--CA 1.5 2.944 0 N-CA-C 119.494 2.558 . . . . 0.0 119.494 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -159.94 -69.4 0.07 Allowed 'General case' 0 N--CA 1.496 1.834 0 CA-C-N 118.974 1.387 . . . . 0.0 109.316 175.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 32.9 t . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 124.74 2.209 . . . . 0.0 110.625 -177.601 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 13.9 p . . . . . 0 CA--C 1.581 2.137 0 CA-C-O 118.976 -0.535 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -68.94 86.86 0.46 Allowed 'Trans proline' 0 CA--C 1.572 2.397 0 C-N-CA 122.698 2.266 . . . . 0.0 115.635 177.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -104.11 106.68 54.43 Favored Pre-proline 0 CA--C 1.578 2.033 0 CA-C-O 118.079 -0.962 . . . . 0.0 111.541 -176.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -79.09 84.38 2.06 Favored 'Trans proline' 0 CA--C 1.571 2.344 0 C-N-CA 122.388 2.059 . . . . 0.0 112.967 175.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.4 ppt_? -68.47 -9.63 50.04 Favored 'General case' 0 CA--C 1.577 2.007 0 N-CA-C 119.613 3.19 . . . . 0.0 119.613 -174.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.64 78.01 0.08 OUTLIER Glycine 0 N--CA 1.488 2.11 0 CA-C-N 120.525 1.511 . . . . 0.0 114.077 178.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . 0.289 46.2 mm 63.29 -71.09 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 C-N-CA 126.477 1.911 . . . . 0.0 113.868 176.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.5 mt 71.39 127.02 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 C-N-CA 125.424 1.489 . . . . 0.0 110.601 -178.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.8 pt -97.49 164.01 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 120.407 -1.433 . . . . 0.0 112.047 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 86.88 75.97 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.123 0 C-N-CA 126.795 2.038 . . . . 0.0 110.499 -174.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.439 ' H ' ' HA ' ' A' ' 23' ' ' CYS . 0.7 OUTLIER -125.83 149.85 48.31 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 123.402 1.572 . . . . 0.0 113.799 -177.847 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -79.5 165.05 23.42 Favored 'General case' 0 CA--C 1.573 1.832 0 O-C-N 120.944 -1.097 . . . . 0.0 112.358 174.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.21 132.64 44.37 Favored 'General case' 0 CA--C 1.574 1.868 0 O-C-N 120.611 -1.306 . . . . 0.0 111.348 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 116.28 13.89 8.0 Favored Glycine 0 CA--C 1.558 2.776 0 N-CA-C 115.705 1.042 . . . . 0.0 115.705 -172.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -129.49 152.3 49.17 Favored 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 119.187 1.493 . . . . 0.0 110.433 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 54.3 mt -72.28 125.94 28.58 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.095 -1.003 . . . . 0.0 113.304 -177.029 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.8 p -121.29 143.51 49.13 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 124.164 0.985 . . . . 0.0 112.271 -177.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.5 mt -78.77 -72.13 0.4 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.035 -1.04 . . . . 0.0 109.279 174.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 60.7 m-20 -99.03 -165.59 1.25 Allowed 'General case' 0 CA--C 1.578 2.046 0 CA-C-N 119.229 0.922 . . . . 0.0 112.551 172.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.1 t -82.8 -24.68 33.29 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 119.784 -1.822 . . . . 0.0 114.964 172.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.24 62.66 6.06 Favored 'General case' 0 CA--C 1.574 1.867 0 CA-C-O 125.057 2.36 . . . . 0.0 111.672 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -137.68 -59.49 0.67 Allowed 'General case' 0 CA--C 1.566 1.558 0 CA-C-N 111.531 -2.577 . . . . 0.0 109.929 -174.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.439 ' HA ' ' H ' ' A' ' 11' ' ' LEU . 71.9 m -83.29 155.03 23.82 Favored 'General case' 0 CA--C 1.57 1.734 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 175.479 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.6 mtpt -60.75 -53.51 56.51 Favored 'General case' 0 N--CA 1.502 2.147 0 C-N-CA 124.089 0.956 . . . . 0.0 109.877 171.234 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 92.2 p -81.88 101.84 10.48 Favored 'General case' 0 CA--C 1.569 1.689 0 N-CA-C 105.353 -2.091 . . . . 0.0 105.353 170.06 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -72.7 76.72 1.11 Allowed 'General case' 0 N--CA 1.501 2.121 0 CA-C-O 124.973 2.32 . . . . 0.0 113.418 -173.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 t -139.94 70.54 1.36 Allowed 'General case' 0 CA--C 1.562 1.427 0 CA-C-N 111.99 -2.368 . . . . 0.0 108.28 -178.163 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.2 t -78.0 108.75 11.5 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 173.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.18 120.16 39.46 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-O 122.861 1.315 . . . . 0.0 112.856 -171.424 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.46 ' HB2' HG12 ' A' ' 57' ' ' VAL . 1.9 t60 -82.18 153.6 25.89 Favored 'General case' 0 CA--C 1.563 1.48 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -174.362 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -76.8 8.2 3.94 Favored 'General case' 0 CA--C 1.586 2.352 0 N-CA-C 116.402 2.001 . . . . 0.0 116.402 172.046 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.277 44.3 p 75.81 97.07 0.07 Allowed 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 127.063 2.145 . . . . 0.0 111.681 -178.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.28 4.2 mp 75.27 -46.94 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 C-N-CA 125.565 1.546 . . . . 0.0 114.305 174.41 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.0 mp -77.83 -126.85 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.158 0 CA-C-N 121.565 1.984 . . . . 0.0 112.249 -174.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.1 p -156.84 94.6 1.45 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 122.924 2.602 . . . . 0.0 116.119 178.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 tt -161.28 92.75 0.92 Allowed 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 103.724 -2.695 . . . . 0.0 103.724 173.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.5 m -110.32 116.11 30.88 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.312 -0.868 . . . . 0.0 112.222 -173.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -124.12 137.55 54.54 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 124.242 1.017 . . . . 0.0 109.782 -178.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 98.5 m -68.58 142.39 55.19 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 119.989 -1.694 . . . . 0.0 113.46 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -135.35 -176.75 4.37 Favored 'General case' 0 CA--C 1.565 1.555 0 CA-C-N 113.558 -1.656 . . . . 0.0 113.183 -173.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.6 pp -82.29 161.9 22.47 Favored 'General case' 0 CA--C 1.572 1.799 0 CA-C-O 122.429 1.109 . . . . 0.0 112.807 174.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -77.97 152.99 32.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.213 -0.929 . . . . 0.0 112.713 175.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.62 159.0 30.65 Favored 'General case' 0 CA--C 1.569 1.697 0 CA-C-O 123.972 1.844 . . . . 0.0 115.278 -174.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 56.8 mtt85 -126.53 168.13 14.69 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-N 113.475 -1.693 . . . . 0.0 110.939 -177.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -44.51 135.21 4.87 Favored 'General case' 0 CA--C 1.574 1.884 0 N-CA-C 116.953 2.205 . . . . 0.0 116.953 -173.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.39 6.6 p30 67.88 14.04 9.32 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 116.957 2.206 . . . . 0.0 116.957 -173.497 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.5 t -117.41 146.29 43.54 Favored 'General case' 0 CA--C 1.565 1.546 0 CA-C-O 122.867 1.318 . . . . 0.0 110.56 173.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -60.11 139.68 57.35 Favored 'General case' 0 CA--C 1.571 1.753 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.611 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 28.5 p -141.88 150.74 41.93 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 113.289 -1.778 . . . . 0.0 114.692 -174.596 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.8 t -79.83 109.67 14.47 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 173.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.03 -43.46 64.95 Favored 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -105.23 144.71 31.64 Favored 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 170.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 22.3 p -126.79 139.03 53.41 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.196 -1.565 . . . . 0.0 112.295 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -98.39 -169.24 1.77 Allowed 'General case' 0 CA--C 1.576 1.965 0 CA-C-N 113.098 -1.864 . . . . 0.0 109.513 173.074 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -103.22 62.53 0.79 Allowed 'General case' 0 N--CA 1.499 2.016 0 CA-C-O 123.258 1.504 . . . . 0.0 108.017 174.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -162.61 177.4 38.74 Favored Glycine 0 N--CA 1.475 1.272 0 CA-C-N 113.554 -1.657 . . . . 0.0 112.012 -174.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.46 HG12 ' HB2' ' A' ' 30' ' ' HIS . 3.4 t -78.34 141.06 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 CA-C-O 123.396 1.569 . . . . 0.0 111.764 -167.194 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -107.54 136.53 47.16 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 114.165 -1.38 . . . . 0.0 112.964 -172.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -68.41 -19.94 64.63 Favored 'General case' 0 CA--C 1.592 2.572 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 172.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.67 111.97 1.21 Allowed 'General case' 0 CA--C 1.575 1.925 0 C-N-CA 128.038 2.535 . . . . 0.0 104.837 -175.409 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 40.2 m -58.64 155.49 29.34 Favored Pre-proline 0 CA--C 1.588 2.442 0 O-C-N 118.946 -2.346 . . . . 0.0 116.75 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -64.2 168.59 12.24 Favored 'Trans proline' 0 CA--C 1.573 2.434 0 C-N-CA 122.691 2.26 . . . . 0.0 115.678 175.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 60.9 m -73.94 150.26 40.91 Favored 'General case' 0 CA--C 1.575 1.94 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -177.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.71 -175.96 1.84 Allowed 'General case' 0 CA--C 1.583 2.23 0 N-CA-C 116.97 2.211 . . . . 0.0 116.97 -174.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.46 114.38 1.99 Allowed 'General case' 0 CA--C 1.572 1.826 0 O-C-N 120.474 -1.391 . . . . 0.0 114.306 -179.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 80.83 15.61 77.17 Favored Glycine 0 N--CA 1.493 2.489 0 N-CA-C 119.43 2.532 . . . . 0.0 119.43 -174.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 tt -132.75 132.46 42.31 Favored 'General case' 0 CA--C 1.568 1.641 0 CA-C-N 119.024 1.412 . . . . 0.0 108.267 -174.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.07 158.06 15.77 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -173.367 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 16.0 t -94.54 111.56 23.32 Favored 'General case' 0 CA--C 1.568 1.671 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.907 172.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -97.0 105.44 17.59 Favored 'General case' 0 CA--C 1.567 1.619 0 O-C-N 120.452 -1.405 . . . . 0.0 110.818 -175.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -71.78 76.65 0.68 Allowed Glycine 0 N--CA 1.495 2.569 0 N-CA-C 116.641 1.416 . . . . 0.0 116.641 -177.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -124.39 -37.33 2.54 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 115.777 1.769 . . . . 0.0 115.777 -176.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -92.11 82.1 5.05 Favored 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 122.029 2.195 . . . . 0.0 112.282 -177.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 53.6 p -102.31 65.81 0.97 Allowed 'General case' 0 CA--C 1.57 1.727 0 CA-C-O 122.663 1.221 . . . . 0.0 111.847 174.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 48.8 tp -91.23 90.49 7.79 Favored 'General case' 0 CA--C 1.564 1.511 0 C-N-CA 124.702 1.201 . . . . 0.0 109.17 174.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.1 p -53.79 -33.89 24.06 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.394 0 N-CA-C 118.307 2.706 . . . . 0.0 118.307 -174.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -85.68 74.23 2.46 Favored Glycine 0 N--CA 1.495 2.578 0 CA-C-N 119.381 0.991 . . . . 0.0 113.999 174.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.6 t -149.24 165.75 30.94 Favored 'General case' 0 CA--C 1.57 1.749 0 CA-C-O 122.045 0.926 . . . . 0.0 112.572 -170.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.402 ' CD1' ' H ' ' A' ' 80' ' ' THR . 1.3 pp -76.49 -77.07 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.146 0 O-C-N 120.801 -1.187 . . . . 0.0 112.002 177.359 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.402 ' H ' ' CD1' ' A' ' 79' ' ' ILE 0.251 14.5 t -134.63 43.66 2.73 Favored 'General case' 0 N--CA 1.517 2.889 0 CA-C-O 126.129 2.871 . . . . 0.0 117.113 175.233 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -145.51 68.99 1.22 Allowed 'General case' 0 CA--C 1.57 1.731 0 CA-C-N 109.866 -3.334 . . . . 0.0 102.376 170.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 16.0 p -99.76 -79.13 0.49 Allowed 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.859 0.864 . . . . 0.0 109.863 -170.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -124.45 66.98 1.07 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 120.336 -1.477 . . . . 0.0 109.173 173.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -134.0 179.77 6.05 Favored 'General case' 0 CA--C 1.574 1.902 0 CA-C-O 122.628 1.204 . . . . 0.0 112.82 -173.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -102.41 169.58 19.65 Favored Glycine 0 N--CA 1.489 2.213 0 O-C-N 120.705 -1.247 . . . . 0.0 115.373 174.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 35.5 mm -110.54 135.46 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 173.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.611 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 23.1 m -63.2 131.1 47.3 Favored 'General case' 0 CA--C 1.57 1.748 0 O-C-N 120.528 -1.357 . . . . 0.0 114.352 173.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 -144.6 148.27 34.15 Favored 'General case' 0 CA--C 1.563 1.48 0 O-C-N 120.731 -1.23 . . . . 0.0 109.718 173.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -96.87 130.18 44.2 Favored 'General case' 0 CA--C 1.565 1.55 0 O-C-N 120.692 -1.255 . . . . 0.0 109.835 176.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 61.8 t -93.53 -59.06 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.098 -174.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -145.63 61.97 0.47 Allowed Glycine 0 N--CA 1.494 2.512 0 O-C-N 121.528 -0.733 . . . . 0.0 114.672 174.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 31.4 ttm180 65.76 -75.15 0.05 Allowed 'General case' 0 N--CA 1.5 2.042 0 C-N-CA 125.376 1.471 . . . . 0.0 113.092 -175.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.0 t . . . . . 0 CA--C 1.565 1.532 0 CA-C-O 123.71 1.719 . . . . 0.0 113.247 176.933 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 CA--C 1.586 2.347 0 CA-C-O 114.472 -2.68 . . . . 0.0 116.571 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -77.21 82.65 2.31 Favored 'Trans proline' 0 CA--C 1.57 2.322 0 CA-C-N 127.829 3.832 . . . . 0.0 115.372 -175.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -91.6 129.51 42.44 Favored Pre-proline 0 CA--C 1.584 2.287 0 CA-C-O 117.188 -1.387 . . . . 0.0 111.458 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -44.75 -31.02 4.67 Favored 'Trans proline' 0 N--CA 1.503 2.062 1 N-CA-C 122.518 4.007 . . . . 0.0 122.518 -175.117 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -12.28 51.92 Favored 'General case' 0 CA--C 1.581 2.161 0 N-CA-C 117.407 2.373 . . . . 0.0 117.407 174.238 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 103.39 25.37 7.4 Favored Glycine 0 N--CA 1.497 2.731 0 N-CA-C 119.57 2.588 . . . . 0.0 119.57 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . 0.319 48.9 mt 65.86 -73.3 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.143 0 C-N-CA 126.571 1.949 . . . . 0.0 112.902 175.394 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 71.8 mt -134.2 102.0 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 5.7 pt -116.91 -129.05 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.196 0 O-C-N 121.764 -0.585 . . . . 0.0 111.056 -175.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 85.72 87.41 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 126.733 2.013 . . . . 0.0 114.327 174.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -138.08 155.07 49.14 Favored 'General case' 0 CA--C 1.574 1.873 0 CA-C-O 122.401 1.096 . . . . 0.0 110.074 172.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -78.11 164.09 25.3 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 119.376 -2.077 . . . . 0.0 114.732 -173.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -73.91 150.18 41.01 Favored 'General case' 0 CA--C 1.573 1.854 0 CA-C-O 122.239 1.019 . . . . 0.0 110.606 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.59 24.76 34.96 Favored Glycine 0 CA--C 1.562 3.027 0 O-C-N 121.484 -0.76 . . . . 0.0 114.819 -170.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -132.95 143.57 49.55 Favored 'General case' 0 CA--C 1.569 1.699 0 C-N-CA 125.632 1.573 . . . . 0.0 108.763 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 34.9 mt -70.92 134.19 47.04 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -174.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.7 p -140.48 152.68 45.81 Favored 'General case' 0 CA--C 1.561 1.373 0 C-N-CA 124.002 0.921 . . . . 0.0 113.124 -174.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -85.4 -77.88 0.28 Allowed 'General case' 0 CA--C 1.567 1.616 0 CA-C-O 117.743 -1.122 . . . . 0.0 108.222 172.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -96.35 170.75 9.02 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 121.149 1.795 . . . . 0.0 114.114 174.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.8 m -69.4 -10.69 59.07 Favored 'General case' 0 N--CA 1.508 2.451 0 N-CA-C 117.077 2.251 . . . . 0.0 117.077 174.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.41 52.82 2.56 Favored 'General case' 0 CA--C 1.571 1.764 0 CA-C-O 123.554 1.645 . . . . 0.0 114.939 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -141.32 -49.59 0.41 Allowed 'General case' 0 CA--C 1.574 1.878 0 CA-C-N 113.968 -1.469 . . . . 0.0 113.98 -177.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 67.4 m -84.19 160.92 20.73 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 116.15 1.907 . . . . 0.0 116.15 -174.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -60.53 -54.24 47.79 Favored 'General case' 0 N--CA 1.504 2.232 0 C-N-CA 124.754 1.222 . . . . 0.0 109.112 171.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.8 t -82.64 92.25 7.12 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 102.07 -3.307 . . . . 0.0 102.07 167.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -72.75 69.19 0.9 Allowed 'General case' 0 N--CA 1.497 1.922 0 CA-C-O 124.64 2.162 . . . . 0.0 116.435 -170.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 43.9 t -145.44 96.39 2.82 Favored 'General case' 0 CA--C 1.557 1.225 0 CA-C-N 112.643 -2.071 . . . . 0.0 110.155 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 15.6 t -78.08 115.08 17.55 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 103.802 -2.666 . . . . 0.0 103.802 171.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -98.84 123.7 43.26 Favored 'General case' 0 CA--C 1.566 1.56 0 CA-C-O 123.156 1.455 . . . . 0.0 114.538 -170.387 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.55 ' HB2' HG12 ' A' ' 57' ' ' VAL . 12.2 t-80 -87.23 116.77 25.54 Favored 'General case' 0 CA--C 1.562 1.418 0 CA-C-N 114.026 -1.443 . . . . 0.0 113.603 -174.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -83.42 56.35 3.54 Favored 'General case' 0 CA--C 1.581 2.143 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 174.221 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 17.7 p 77.18 109.73 0.07 Allowed 'General case' 0 N--CA 1.505 2.308 0 N-CA-C 119.454 3.131 . . . . 0.0 119.454 171.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.302 4.7 mp 53.52 -87.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 C-N-CA 126.79 2.036 . . . . 0.0 115.766 172.238 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.7 tp -103.37 88.1 3.03 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 175.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 54.4 p -136.2 150.5 49.04 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 116.303 1.964 . . . . 0.0 116.303 -172.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 46.2 tp -80.37 117.09 20.81 Favored 'General case' 0 CA--C 1.569 1.709 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 173.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.9 m -92.6 137.2 32.57 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 122.964 1.364 . . . . 0.0 114.515 -171.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.8 ttt180 -134.53 137.35 43.76 Favored 'General case' 0 N--CA 1.495 1.8 0 C-N-CA 124.055 0.942 . . . . 0.0 110.181 -174.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 67.1 m -65.98 148.23 52.12 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 119.606 -1.934 . . . . 0.0 114.946 -177.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.67 -179.47 5.94 Favored 'General case' 0 CA--C 1.57 1.74 0 CA-C-N 113.488 -1.687 . . . . 0.0 112.83 -174.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.2 mt -81.65 138.91 35.24 Favored 'General case' 0 CA--C 1.566 1.579 0 O-C-N 121.069 -1.02 . . . . 0.0 112.932 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.9 pttt -70.67 134.5 47.58 Favored 'General case' 0 CA--C 1.573 1.852 0 O-C-N 121.606 -0.684 . . . . 0.0 110.3 173.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.41 154.73 38.66 Favored 'General case' 0 CA--C 1.561 1.389 0 N-CA-C 118.37 2.73 . . . . 0.0 118.37 -171.122 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -113.09 171.73 7.37 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 112.569 -2.105 . . . . 0.0 112.722 -177.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -58.94 125.01 21.79 Favored 'General case' 0 CA--C 1.568 1.669 0 CA-C-N 114.838 -1.073 . . . . 0.0 113.009 -174.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 85.51 18.22 0.12 Allowed 'General case' 0 CA--C 1.586 2.338 0 C-N-CA 125.956 1.702 . . . . 0.0 114.177 -173.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.3 t -119.77 151.79 38.24 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 119.953 -1.717 . . . . 0.0 112.312 175.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -74.51 120.71 20.44 Favored 'General case' 0 CA--C 1.575 1.918 0 CA-C-O 123.755 1.74 . . . . 0.0 112.534 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.495 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 19.3 p -122.86 152.53 40.66 Favored 'General case' 0 CA--C 1.562 1.426 0 C-N-CA 127.146 2.178 . . . . 0.0 112.482 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 65.9 m -75.57 123.4 25.43 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.403 -1.436 . . . . 0.0 107.804 173.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.82 -49.33 25.73 Favored 'General case' 0 CA--C 1.565 1.525 0 N-CA-C 116.884 2.179 . . . . 0.0 116.884 -172.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -91.97 151.84 20.31 Favored 'General case' 0 CA--C 1.566 1.591 0 CA-C-N 118.758 0.708 . . . . 0.0 109.867 173.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.6 p -121.0 146.58 46.54 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 124.411 2.053 . . . . 0.0 110.588 174.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -98.47 -126.29 0.16 Allowed 'General case' 0 CA--C 1.569 1.711 0 CA-C-N 112.469 -2.15 . . . . 0.0 105.884 174.103 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -149.17 70.83 1.1 Allowed 'General case' 0 CA--C 1.564 1.511 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 169.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 175.47 -135.78 3.14 Favored Glycine 0 N--CA 1.483 1.819 0 CA-C-N 115.644 -0.707 . . . . 0.0 113.999 -176.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.55 HG12 ' HB2' ' A' ' 30' ' ' HIS . 3.4 t -79.76 144.22 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.175 0 CA-C-O 122.25 1.024 . . . . 0.0 112.196 -172.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -123.6 135.84 54.18 Favored 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 123.515 0.726 . . . . 0.0 112.56 -173.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -60.42 -51.08 71.02 Favored 'General case' 0 N--CA 1.503 2.218 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 177.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -135.41 122.02 20.79 Favored 'General case' 0 CA--C 1.559 1.311 0 N-CA-C 103.892 -2.633 . . . . 0.0 103.892 174.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 97.2 m -43.91 130.66 4.2 Favored Pre-proline 0 CA--C 1.592 2.588 0 N-CA-C 117.852 2.538 . . . . 0.0 117.852 -174.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -77.65 60.75 7.28 Favored 'Trans proline' 0 CA--C 1.576 2.614 0 C-N-CA 123.179 2.586 . . . . 0.0 118.637 -173.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 37.8 m 61.7 163.92 0.08 Allowed 'General case' 0 CA--C 1.582 2.198 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.42 174.07 11.83 Favored 'General case' 0 CA--C 1.575 1.94 0 N-CA-C 115.19 1.552 . . . . 0.0 115.19 178.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.99 108.65 1.26 Allowed 'General case' 0 CA--C 1.574 1.868 0 O-C-N 120.476 -1.39 . . . . 0.0 112.469 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 93.18 27.7 13.07 Favored Glycine 0 N--CA 1.497 2.709 0 N-CA-C 118.036 1.974 . . . . 0.0 118.036 -173.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 12.3 tp -140.9 138.42 33.87 Favored 'General case' 0 CA--C 1.567 1.614 0 CA-C-N 118.794 1.297 . . . . 0.0 110.225 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -98.74 154.1 18.23 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.708 -1.245 . . . . 0.0 112.828 -176.1 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.2 t -94.77 146.62 24.06 Favored 'General case' 0 CA--C 1.575 1.911 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.943 172.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -97.6 -115.17 0.14 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 120.381 -1.449 . . . . 0.0 110.378 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 179.49 100.98 0.14 Allowed Glycine 0 N--CA 1.492 2.398 0 CA-C-N 122.33 2.332 . . . . 0.0 116.199 -176.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -96.16 -84.4 0.35 Allowed 'General case' 0 CA--C 1.578 2.044 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 171.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.88 159.59 36.94 Favored 'General case' 0 CA--C 1.574 1.882 0 C-N-CA 125.33 1.452 . . . . 0.0 110.056 176.601 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 58.8 p -154.46 -80.71 0.09 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.079 -1.638 . . . . 0.0 111.436 174.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 74.94 76.2 0.11 Allowed 'General case' 0 CA--C 1.581 2.166 0 C-N-CA 125.883 1.673 . . . . 0.0 113.569 -178.476 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . 0.355 3.9 p 50.38 -62.12 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.287 0 N-CA-C 121.041 3.719 . . . . 0.0 121.041 174.026 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 164.34 -58.62 0.26 Allowed Glycine 0 N--CA 1.494 2.541 0 N-CA-C 116.905 1.522 . . . . 0.0 116.905 -176.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.6 t -75.05 -12.35 60.3 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 118.914 2.931 . . . . 0.0 118.914 -177.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 43.6 mm -109.57 -77.19 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.172 0 N-CA-C 106.884 -1.525 . . . . 0.0 106.884 174.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.253 43.7 p 68.16 146.6 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 117.766 2.506 . . . . 0.0 117.766 174.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -117.16 117.0 28.4 Favored 'General case' 0 CA--C 1.565 1.524 0 N-CA-C 101.939 -3.356 . . . . 0.0 101.939 172.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 41.1 p -90.41 69.04 6.9 Favored 'General case' 0 N--CA 1.503 2.184 0 CA-C-O 126.736 3.16 . . . . 0.0 115.079 -171.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -145.23 85.0 1.72 Allowed 'General case' 0 CA--C 1.564 1.513 0 CA-C-N 109.272 -3.604 . . . . 0.0 105.882 173.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -93.85 167.1 11.85 Favored 'General case' 0 CA--C 1.574 1.902 0 O-C-N 120.609 -1.307 . . . . 0.0 112.324 -174.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.22 162.33 23.85 Favored Glycine 0 N--CA 1.495 2.576 0 N-CA-C 119.116 2.406 . . . . 0.0 119.116 -174.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 23.2 mm -95.96 136.76 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 O-C-N 120.975 -1.309 . . . . 0.0 110.774 -171.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.495 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 53.2 m -67.85 124.22 22.72 Favored 'General case' 0 CA--C 1.569 1.691 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 174.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -144.12 159.79 42.04 Favored 'General case' 0 CA--C 1.565 1.525 0 CA-C-O 123.328 1.537 . . . . 0.0 111.642 174.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -99.44 132.64 44.63 Favored 'General case' 0 CA--C 1.564 1.512 0 O-C-N 120.855 -1.153 . . . . 0.0 110.7 175.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 59.9 t -106.83 5.64 9.99 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.43 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -179.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.15 -50.5 66.57 Favored Glycine 0 N--CA 1.497 2.765 0 O-C-N 119.132 -2.23 . . . . 0.0 118.358 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 52.6 ttp180 -86.03 81.96 8.28 Favored 'General case' 0 CA--C 1.572 1.798 0 CA-C-N 118.08 0.94 . . . . 0.0 110.346 173.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 94.6 p . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 123.329 1.537 . . . . 0.0 110.676 -175.778 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 14.0 m . . . . . 0 CA--C 1.578 2.044 0 CA-C-O 118.411 -0.804 . . . . 0.0 110.569 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -80.63 73.42 6.03 Favored 'Trans proline' 0 CA--C 1.572 2.389 0 CA-C-N 123.015 2.112 . . . . 0.0 114.67 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -101.9 114.97 65.39 Favored Pre-proline 0 CA--C 1.578 2.046 0 CA-C-O 118.103 -0.951 . . . . 0.0 111.297 -175.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -79.8 88.57 1.42 Allowed 'Trans proline' 0 CA--C 1.571 2.341 0 CA-C-N 123.051 2.125 . . . . 0.0 114.383 -178.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -78.23 -22.13 48.9 Favored 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -177.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 86.97 -56.48 4.63 Favored Glycine 0 N--CA 1.499 2.864 0 CA-C-N 121.54 1.973 . . . . 0.0 116.272 -174.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 63.9 mt -70.38 -47.25 67.21 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.174 0 C-N-CA 123.801 0.841 . . . . 0.0 111.76 170.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 62.8 mt -83.25 86.83 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 CA-C-N 120.052 1.296 . . . . 0.0 108.782 178.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.474 HG13 ' H ' ' A' ' 10' ' ' ASN . 7.8 pt -121.88 -85.68 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 C-N-CA 123.976 0.91 . . . . 0.0 109.056 -179.547 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.474 ' H ' HG13 ' A' ' 9' ' ' ILE . 0.8 OUTLIER 47.93 82.48 0.04 OUTLIER 'General case' 0 CA--C 1.58 2.128 0 N-CA-C 118.017 2.599 . . . . 0.0 118.017 174.156 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 mt -131.54 146.48 52.24 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 123.568 1.651 . . . . 0.0 113.838 175.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -80.51 162.6 24.27 Favored 'General case' 0 CA--C 1.567 1.616 0 CA-C-N 114.193 -1.367 . . . . 0.0 113.47 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -76.72 131.78 38.95 Favored 'General case' 0 CA--C 1.578 2.041 0 N-CA-C 107.788 -1.189 . . . . 0.0 107.788 173.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 101.66 26.7 7.48 Favored Glycine 0 CA--C 1.561 2.948 0 CA-C-N 115.766 -0.652 . . . . 0.0 114.469 -171.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -129.24 139.46 51.83 Favored 'General case' 0 CA--C 1.566 1.574 0 C-N-CA 125.121 1.368 . . . . 0.0 109.243 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.0 mp -68.08 124.96 24.86 Favored 'General case' 0 CA--C 1.574 1.868 0 O-C-N 121.152 -0.967 . . . . 0.0 112.191 -178.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 6.8 p -131.39 152.1 50.94 Favored 'General case' 0 CA--C 1.561 1.399 0 C-N-CA 124.229 1.011 . . . . 0.0 113.072 -174.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 97.7 mt -84.09 -74.97 0.36 Allowed 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 118.092 -0.956 . . . . 0.0 108.917 174.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -98.57 172.93 7.18 Favored 'General case' 0 N--CA 1.501 2.09 0 CA-C-N 120.998 1.726 . . . . 0.0 113.331 173.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.9 m -71.92 -9.67 58.68 Favored 'General case' 0 N--CA 1.508 2.463 0 N-CA-C 116.639 2.089 . . . . 0.0 116.639 173.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.72 4.2 12.18 Favored 'General case' 0 CA--C 1.572 1.816 0 N-CA-C 118.27 2.693 . . . . 0.0 118.27 176.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -97.77 -35.59 10.49 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 115.346 1.609 . . . . 0.0 115.346 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 71.4 m -81.05 155.77 26.17 Favored 'General case' 0 CA--C 1.564 1.498 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 177.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -62.96 -50.9 68.98 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.385 -0.822 . . . . 0.0 110.089 172.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.0 p -82.46 97.39 8.38 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 102.851 -3.018 . . . . 0.0 102.851 167.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -70.85 80.55 0.63 Allowed 'General case' 0 N--CA 1.498 1.94 0 CA-C-O 124.6 2.143 . . . . 0.0 115.354 -171.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 41.0 t -158.28 93.12 1.2 Allowed 'General case' 0 CA--C 1.557 1.218 0 CA-C-N 112.248 -2.251 . . . . 0.0 110.699 -176.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.8 t -80.22 113.98 18.79 Favored 'General case' 0 CA--C 1.56 1.348 0 N-CA-C 104.933 -2.247 . . . . 0.0 104.933 171.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 46.7 tp60 -91.99 115.79 28.37 Favored 'General case' 0 CA--C 1.558 1.287 0 CA-C-O 122.347 1.07 . . . . 0.0 113.884 -172.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.515 ' HB2' HG12 ' A' ' 57' ' ' VAL . 24.3 t-80 -81.1 117.28 21.54 Favored 'General case' 0 CA--C 1.562 1.432 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.734 176.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -72.15 56.83 0.34 Allowed 'General case' 0 CA--C 1.581 2.163 0 N-CA-C 116.923 2.194 . . . . 0.0 116.923 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 44.3 p 61.25 69.13 0.68 Allowed 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 126.037 1.735 . . . . 0.0 115.071 173.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.331 3.7 mp 71.1 -32.84 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.534 0 C-N-CA 125.191 1.396 . . . . 0.0 113.762 -179.079 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.1 tp -53.07 -20.95 4.06 Favored 'General case' 0 CA--C 1.586 2.364 0 N-CA-C 117.627 2.454 . . . . 0.0 117.627 174.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.288 26.3 p 77.93 1.44 2.83 Favored 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 121.692 3.96 . . . . 0.0 121.692 172.455 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.5 tp -73.64 96.25 2.45 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 121.711 2.05 . . . . 0.0 106.76 172.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.9 m -97.68 107.37 19.85 Favored 'General case' 0 CA--C 1.56 1.344 0 CA-C-O 123.139 1.447 . . . . 0.0 111.648 -171.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -131.22 132.83 44.93 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-N 114.546 -1.206 . . . . 0.0 108.98 -174.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 99.5 m -62.42 150.56 39.53 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 122.402 2.365 . . . . 0.0 116.504 -174.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -132.61 173.41 11.36 Favored 'General case' 0 CA--C 1.568 1.658 0 CA-C-N 114.162 -1.381 . . . . 0.0 113.842 -174.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 26.6 tp -85.47 146.19 27.07 Favored 'General case' 0 CA--C 1.569 1.677 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -174.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -69.95 143.32 52.7 Favored 'General case' 0 CA--C 1.577 2.001 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 175.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.492 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . . . -78.93 169.61 17.96 Favored 'General case' 0 CA--C 1.579 2.077 0 N-CA-C 118.272 2.694 . . . . 0.0 118.272 -173.147 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 46.3 mtp180 -112.66 173.87 6.17 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 113.19 -1.823 . . . . 0.0 112.57 -178.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -64.2 136.76 57.51 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 122.083 0.944 . . . . 0.0 113.134 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 70.98 23.31 4.29 Favored 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 124.93 1.292 . . . . 0.0 114.118 -173.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.9 t -121.87 148.54 44.59 Favored 'General case' 0 CA--C 1.558 1.266 0 CA-C-O 122.596 1.189 . . . . 0.0 110.263 174.511 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -67.53 133.49 49.56 Favored 'General case' 0 CA--C 1.576 1.953 0 CA-C-O 123.749 1.738 . . . . 0.0 112.137 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 87' ' ' CYS . 22.3 p -137.41 156.43 48.2 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 112.855 -1.975 . . . . 0.0 112.552 -174.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 92.9 p -81.64 117.57 22.1 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 172.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.36 -55.31 7.3 Favored 'General case' 0 CA--C 1.583 2.244 0 CA-C-O 122.813 1.292 . . . . 0.0 108.181 172.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -155.24 127.64 7.82 Favored 'General case' 0 CA--C 1.573 1.838 0 N-CA-C 101.795 -3.409 . . . . 0.0 101.795 169.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.4 m -88.39 -70.43 0.64 Allowed 'General case' 0 CA--C 1.568 1.651 0 O-C-N 119.434 -2.042 . . . . 0.0 106.125 171.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -152.59 -72.67 0.14 Allowed 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 124.694 1.198 . . . . 0.0 109.816 173.284 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -162.43 -43.45 0.04 OUTLIER 'General case' 0 CA--C 1.579 2.084 0 C-N-CA 125.128 1.371 . . . . 0.0 113.851 -173.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -96.95 -120.44 3.94 Favored Glycine 0 N--CA 1.485 1.942 0 N-CA-C 116.94 1.536 . . . . 0.0 116.94 -172.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.515 HG12 ' HB2' ' A' ' 30' ' ' HIS . 3.1 t -82.16 141.04 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 CA-C-O 122.415 1.102 . . . . 0.0 111.11 -175.427 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 17.0 m-30 -122.65 148.84 44.79 Favored 'General case' 0 CA--C 1.559 1.317 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 -171.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -77.97 -9.05 58.91 Favored 'General case' 0 CA--C 1.585 2.311 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 173.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.61 140.04 9.45 Favored 'General case' 0 CA--C 1.571 1.752 0 C-N-CA 126.68 1.992 . . . . 0.0 106.686 -174.019 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 96.3 m -82.64 156.26 68.13 Favored Pre-proline 0 CA--C 1.581 2.135 0 N-CA-C 116.706 2.113 . . . . 0.0 116.706 177.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.51 171.52 16.96 Favored 'Trans proline' 0 CA--C 1.571 2.361 0 C-N-CA 122.704 2.269 . . . . 0.0 112.989 173.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.492 ' SG ' ' HB3' ' A' ' 43' ' ' ALA . 5.3 m -85.85 170.07 12.74 Favored 'General case' 0 CA--C 1.568 1.666 0 CA-C-O 123.751 1.739 . . . . 0.0 115.042 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -59.73 154.68 17.53 Favored 'General case' 0 CA--C 1.572 1.824 0 N-CA-C 115.805 1.78 . . . . 0.0 115.805 178.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -65.62 113.37 4.18 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 122.62 1.2 . . . . 0.0 112.427 -174.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 115.43 -27.08 8.66 Favored Glycine 0 N--CA 1.497 2.756 0 CA-C-N 114.099 -1.41 . . . . 0.0 116.355 -172.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 11.7 tp -97.42 138.81 34.29 Favored 'General case' 0 CA--C 1.569 1.688 0 CA-C-N 118.504 1.152 . . . . 0.0 110.936 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -97.19 148.82 22.69 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.424 -1.423 . . . . 0.0 113.443 -174.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 16.7 t -94.37 100.82 12.78 Favored 'General case' 0 CA--C 1.569 1.681 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.094 173.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -97.23 107.99 20.63 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 120.587 1.54 . . . . 0.0 111.66 -176.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 142.65 123.55 1.83 Allowed Glycine 0 N--CA 1.483 1.782 0 CA-C-O 122.244 0.913 . . . . 0.0 113.261 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -117.55 151.91 36.18 Favored 'General case' 0 CA--C 1.572 1.82 0 CA-C-O 122.315 1.055 . . . . 0.0 109.764 165.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . 0.301 11.5 tmtt? 68.91 -94.03 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 125.351 1.46 . . . . 0.0 109.302 -173.218 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.7 t 59.91 110.06 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 117.683 2.475 . . . . 0.0 117.683 173.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -63.45 -32.91 74.49 Favored 'General case' 0 CA--C 1.584 2.263 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 172.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 91.8 t -77.68 92.8 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.573 1.836 0 O-C-N 120.774 -1.204 . . . . 0.0 107.865 174.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -147.49 -115.33 0.85 Allowed Glycine 0 N--CA 1.483 1.816 0 CA-C-N 115.034 -0.984 . . . . 0.0 114.083 -178.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.4 t -142.52 -67.59 0.37 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 122.26 -0.553 . . . . 0.0 112.351 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 11.6 tt -149.35 136.5 13.33 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.484 0 CA-C-O 123.087 1.422 . . . . 0.0 107.96 176.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.252 0.7 OUTLIER 63.56 158.8 0.08 Allowed 'General case' 0 N--CA 1.502 2.136 0 CA-C-O 123.243 1.497 . . . . 0.0 114.482 -174.727 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -97.57 68.93 2.16 Favored 'General case' 0 CA--C 1.569 1.703 0 O-C-N 120.959 -1.088 . . . . 0.0 112.583 -176.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . 0.297 4.3 t -97.17 -93.42 0.22 Allowed 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 117.634 -1.174 . . . . 0.0 111.011 -175.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -151.45 87.74 1.39 Allowed 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 121.719 2.054 . . . . 0.0 111.678 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -108.82 154.53 21.95 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 123.079 1.418 . . . . 0.0 110.159 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -166.18 154.73 25.5 Favored Glycine 0 N--CA 1.488 2.165 0 O-C-N 121.075 -1.016 . . . . 0.0 112.936 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.7 mm -94.19 138.43 20.59 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.161 0 CA-C-N 119.44 1.62 . . . . 0.0 109.188 -176.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 61.2 m -74.73 123.41 24.88 Favored 'General case' 0 CA--C 1.563 1.461 0 N-CA-C 116.177 1.917 . . . . 0.0 116.177 178.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -141.11 158.62 43.66 Favored 'General case' 0 CA--C 1.561 1.373 0 CA-C-O 123.488 1.614 . . . . 0.0 111.483 179.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -98.15 40.7 1.16 Allowed 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 174.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.0 t 48.95 71.85 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 C-N-CA 127.012 2.125 . . . . 0.0 113.811 174.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -81.0 70.26 3.1 Favored Glycine 0 N--CA 1.493 2.488 0 N-CA-C 115.865 1.106 . . . . 0.0 115.865 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 29.9 mmm180 60.48 66.14 0.97 Allowed 'General case' 0 N--CA 1.501 2.111 0 C-N-CA 124.994 1.318 . . . . 0.0 113.738 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 38.5 t . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 123.963 1.839 . . . . 0.0 114.645 -174.865 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 13.1 m . . . . . 0 CA--C 1.581 2.164 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.63 -35.21 6.25 Favored 'Trans proline' 0 CA--C 1.57 2.319 0 N-CA-C 117.741 2.169 . . . . 0.0 117.741 -178.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -116.36 99.78 52.98 Favored Pre-proline 0 CA--C 1.579 2.075 0 CA-C-N 119.355 0.98 . . . . 0.0 109.763 176.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -63.76 128.78 22.97 Favored 'Trans proline' 0 CA--C 1.567 2.162 0 C-N-CA 122.642 2.228 . . . . 0.0 115.502 176.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -77.74 34.11 0.18 Allowed 'General case' 0 CA--C 1.579 2.082 0 N-CA-C 118.542 2.793 . . . . 0.0 118.542 -174.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 53.19 40.82 60.35 Favored Glycine 0 N--CA 1.5 2.967 0 N-CA-C 120.196 2.838 . . . . 0.0 120.196 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . 0.332 1.1 tt 46.95 14.94 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.586 2.347 0 N-CA-C 120.705 3.594 . . . . 0.0 120.705 -177.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.25 21.8 pt 39.72 78.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.512 2.65 0 C-N-CA 125.896 1.678 . . . . 0.0 115.476 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.0 pt -91.46 136.94 23.0 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 CA-C-O 123.512 1.625 . . . . 0.0 112.138 -173.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 55.7 m-80 -146.63 70.85 1.22 Allowed 'General case' 0 CA--C 1.573 1.853 0 CA-C-N 113.811 -1.54 . . . . 0.0 113.792 -174.316 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mp -131.0 136.44 48.51 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.21 -1.557 . . . . 0.0 112.226 174.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -84.97 172.41 11.35 Favored 'General case' 0 CA--C 1.572 1.814 0 O-C-N 121.365 -0.835 . . . . 0.0 112.887 174.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -77.01 114.54 15.92 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 173.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 135.25 -8.97 4.41 Favored Glycine 0 CA--C 1.56 2.883 0 CA-C-N 114.298 -1.319 . . . . 0.0 115.627 -172.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -114.76 154.65 28.14 Favored 'General case' 0 CA--C 1.569 1.675 0 CA-C-N 120.084 1.942 . . . . 0.0 112.162 -177.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -81.83 147.95 29.1 Favored 'General case' 0 CA--C 1.574 1.866 0 CA-C-O 122.114 0.959 . . . . 0.0 113.303 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.6 p -137.55 -179.03 5.5 Favored 'General case' 0 CA--C 1.575 1.906 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -174.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.6 tp -99.29 -74.14 0.6 Allowed 'General case' 0 CA--C 1.58 2.121 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 171.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -94.87 -173.15 2.9 Favored 'General case' 0 N--CA 1.501 2.12 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 174.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.8 m -78.05 -31.93 50.59 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 119.79 -1.819 . . . . 0.0 114.703 172.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.83 65.43 4.99 Favored 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 124.706 2.193 . . . . 0.0 111.608 173.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -139.96 -50.17 0.48 Allowed 'General case' 0 CA--C 1.566 1.584 0 CA-C-N 111.89 -2.414 . . . . 0.0 111.258 -174.28 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 95.4 m -81.27 140.8 34.64 Favored 'General case' 0 CA--C 1.564 1.518 0 O-C-N 121.162 -0.961 . . . . 0.0 109.997 173.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -53.35 -30.3 38.69 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 118.694 2.85 . . . . 0.0 118.694 -173.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -79.78 -76.68 0.21 Allowed 'General case' 0 CA--C 1.574 1.879 0 CA-C-N 118.219 0.463 . . . . 0.0 110.516 173.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -173.07 -39.67 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.35 0 N-CA-C 116.565 2.061 . . . . 0.0 116.565 -176.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.3 t -97.71 110.52 23.07 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 119.711 3.226 . . . . 0.0 119.711 -169.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 22.5 t -95.41 118.87 32.93 Favored 'General case' 0 CA--C 1.562 1.409 0 N-CA-C 104.436 -2.431 . . . . 0.0 104.436 168.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.99 114.28 27.45 Favored 'General case' 0 CA--C 1.57 1.731 0 CA-C-O 123.185 1.469 . . . . 0.0 114.672 -172.128 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.697 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.1 t60 -82.52 155.54 24.49 Favored 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 126.432 1.893 . . . . 0.0 112.348 177.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.2 p30 -81.88 40.15 0.59 Allowed 'General case' 0 CA--C 1.587 2.396 0 O-C-N 120.434 -1.416 . . . . 0.0 114.21 172.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 48.7 p 63.54 90.02 0.08 Allowed 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 126.429 1.892 . . . . 0.0 113.68 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.301 3.2 mp 69.31 -38.04 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 174.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.3 mt -71.09 -87.41 0.02 OUTLIER 'General case' 0 CA--C 1.576 1.956 0 CA-C-N 122.405 2.366 . . . . 0.0 112.228 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 91.9 p -155.67 -131.25 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.022 0 CA-C-N 122.029 2.195 . . . . 0.0 114.005 174.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 20.7 tp 43.76 75.83 0.09 Allowed 'General case' 0 N--CA 1.502 2.125 0 C-N-CA 125.911 1.684 . . . . 0.0 115.113 -174.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.671 ' HB3' HG11 ' A' ' 57' ' ' VAL . 18.7 m -98.81 86.61 3.55 Favored 'General case' 0 CA--C 1.565 1.531 0 CA-C-O 122.205 1.002 . . . . 0.0 110.69 -174.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -120.36 127.66 52.52 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.653 1.181 . . . . 0.0 109.977 -174.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 74.8 m -66.6 140.42 57.94 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 116.281 1.956 . . . . 0.0 116.281 -174.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -142.34 173.17 11.77 Favored 'General case' 0 CA--C 1.565 1.554 0 CA-C-N 113.312 -1.767 . . . . 0.0 114.314 -173.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.6 pp -84.9 165.52 17.6 Favored 'General case' 0 CA--C 1.573 1.831 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 178.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -74.35 146.69 42.84 Favored 'General case' 0 CA--C 1.574 1.877 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.41 164.04 25.84 Favored 'General case' 0 CA--C 1.571 1.761 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -174.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 65.3 mtt180 -128.87 165.28 21.34 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 122.556 1.17 . . . . 0.0 112.338 -175.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -43.09 126.77 4.08 Favored 'General case' 0 CA--C 1.568 1.656 0 N-CA-C 117.3 2.333 . . . . 0.0 117.3 -172.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 72.39 17.97 4.66 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 115.248 1.573 . . . . 0.0 115.248 -174.09 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.7 t -117.75 150.32 39.3 Favored 'General case' 0 CA--C 1.565 1.533 0 CA-C-O 122.758 1.266 . . . . 0.0 110.619 174.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -65.33 122.0 16.12 Favored 'General case' 0 CA--C 1.573 1.85 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 -175.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.422 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 4.6 t -113.03 137.34 51.56 Favored 'General case' 0 CA--C 1.558 1.275 0 CA-C-N 113.489 -1.687 . . . . 0.0 111.232 174.2 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.1 t -99.68 115.68 30.03 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 172.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.19 -22.33 45.11 Favored 'General case' 0 CA--C 1.572 1.789 0 N-CA-C 115.997 1.851 . . . . 0.0 115.997 -178.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -129.33 154.64 46.68 Favored 'General case' 0 CA--C 1.578 2.027 0 N-CA-C 117.431 2.382 . . . . 0.0 117.431 -176.226 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.6 t 131.47 -152.51 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.523 2 N-CA-C 97.042 -5.17 . . . . 0.0 97.042 -171.552 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.653 3.6 mt 176.02 -69.36 0.01 OUTLIER 'General case' 0 N--CA 1.521 3.075 1 O-C-N 113.353 -5.842 . . . . 0.0 110.608 160.858 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -78.8 -26.81 44.35 Favored 'General case' 0 CA--C 1.577 1.997 0 CA-C-N 112.433 -2.167 . . . . 0.0 108.883 168.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -81.97 159.76 40.05 Favored Glycine 0 CA--C 1.55 2.219 0 N-CA-C 107.619 -2.193 . . . . 0.0 107.619 170.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.697 HG12 ' HB2' ' A' ' 30' ' ' HIS . 93.6 t -70.87 135.67 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 CA-C-O 123.715 1.721 . . . . 0.0 112.028 -163.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 -66.7 124.23 22.3 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 113.014 -1.903 . . . . 0.0 114.779 -172.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -69.3 -40.63 77.57 Favored 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 114.787 1.402 . . . . 0.0 114.787 -174.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -149.95 103.84 3.24 Favored 'General case' 0 CA--C 1.569 1.684 0 N-CA-C 101.593 -3.484 . . . . 0.0 101.593 172.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 57.2 m -39.91 127.61 1.58 Allowed Pre-proline 0 CA--C 1.587 2.396 0 N-CA-C 116.913 2.19 . . . . 0.0 116.913 -173.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -47.83 166.33 0.12 Allowed 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 123.52 2.813 . . . . 0.0 119.266 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 58.4 m -68.01 146.09 53.86 Favored 'General case' 0 CA--C 1.569 1.686 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -178.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -178.72 1.42 Allowed 'General case' 0 CA--C 1.577 2.011 0 N-CA-C 115.268 1.581 . . . . 0.0 115.268 -176.471 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -60.84 112.45 2.05 Favored 'General case' 0 CA--C 1.571 1.76 0 O-C-N 120.349 -1.469 . . . . 0.0 113.096 -175.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.13 -20.65 35.17 Favored Glycine 0 N--CA 1.496 2.699 0 N-CA-C 118.629 2.212 . . . . 0.0 118.629 -173.609 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.1 mp -106.35 151.93 24.23 Favored 'General case' 0 CA--C 1.569 1.689 0 CA-C-N 118.841 1.32 . . . . 0.0 112.183 -178.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.96 158.26 17.87 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-O 122.368 1.08 . . . . 0.0 113.611 -176.598 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 6.1 t -90.71 120.04 31.43 Favored 'General case' 0 CA--C 1.57 1.745 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.526 173.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -96.34 -135.06 0.23 Allowed 'General case' 0 CA--C 1.582 2.193 0 CA-C-N 120.23 1.377 . . . . 0.0 111.775 -174.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -173.25 68.76 0.1 Allowed Glycine 0 N--CA 1.496 2.685 0 O-C-N 119.225 -2.172 . . . . 0.0 117.564 -175.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -108.32 27.8 8.97 Favored 'General case' 0 CA--C 1.581 2.166 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 171.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 59.0 mtmt 67.63 -43.89 0.47 Allowed 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 -174.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 70.2 m 62.41 50.35 3.75 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 116.805 2.15 . . . . 0.0 116.805 174.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 39.5 tp -76.4 -26.65 55.8 Favored 'General case' 0 CA--C 1.58 2.105 0 N-CA-C 115.186 1.551 . . . . 0.0 115.186 174.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.6 p -72.83 73.79 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.582 2.178 0 CA-C-O 123.965 1.84 . . . . 0.0 112.382 175.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 125.71 29.59 0.96 Allowed Glycine 0 CA--C 1.557 2.698 0 N-CA-C 116.723 1.449 . . . . 0.0 116.723 -174.03 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.2 t -151.45 144.01 24.26 Favored 'General case' 0 CA--C 1.566 1.595 0 CA-C-N 119.302 1.551 . . . . 0.0 110.661 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 5.3 tp -76.29 -64.03 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.271 0 O-C-N 121.008 -1.057 . . . . 0.0 111.193 174.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 75.8 p -89.89 166.03 13.75 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 123.39 1.567 . . . . 0.0 110.667 173.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -146.17 91.58 2.08 Favored 'General case' 0 CA--C 1.564 1.486 0 O-C-N 121.101 -0.999 . . . . 0.0 109.374 -174.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 73.5 p -99.51 -82.29 0.44 Allowed 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.64 -0.663 . . . . 0.0 109.945 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -144.28 82.59 1.7 Allowed 'General case' 0 CA--C 1.564 1.483 0 O-C-N 120.903 -1.123 . . . . 0.0 108.638 174.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -113.18 162.69 15.69 Favored 'General case' 0 CA--C 1.57 1.716 0 CA-C-O 123.094 1.426 . . . . 0.0 110.541 -178.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -139.39 -155.68 6.71 Favored Glycine 0 N--CA 1.48 1.575 0 O-C-N 120.909 -1.119 . . . . 0.0 114.555 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.9 mm -128.97 142.64 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.422 ' SG ' ' HB2' ' A' ' 49' ' ' CYS . 35.7 m -70.86 129.45 39.09 Favored 'General case' 0 CA--C 1.564 1.491 0 O-C-N 120.561 -1.337 . . . . 0.0 113.017 173.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 63.6 m-70 -140.46 155.81 46.57 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 123.203 1.478 . . . . 0.0 111.38 176.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -95.33 128.52 42.24 Favored 'General case' 0 CA--C 1.562 1.429 0 CA-C-O 122.367 1.079 . . . . 0.0 110.607 -176.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 9.9 m -103.37 40.42 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.579 2.072 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -174.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 82.13 -69.43 3.33 Favored Glycine 0 N--CA 1.493 2.434 0 O-C-N 120.274 -1.516 . . . . 0.0 116.468 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -86.92 81.35 8.15 Favored 'General case' 0 CA--C 1.572 1.804 0 CA-C-O 121.871 0.843 . . . . 0.0 111.874 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 33.1 t . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 124.804 2.24 . . . . 0.0 111.382 -179.366 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.256 8.8 p . . . . . 0 CA--C 1.585 2.321 0 CA-C-O 114.759 -2.543 . . . . 0.0 116.045 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -71.49 90.08 0.7 Allowed 'Trans proline' 0 CA--C 1.57 2.304 0 CA-C-N 127.315 3.648 . . . . 0.0 114.681 -179.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.5 t70 62.8 87.82 0.13 Allowed Pre-proline 0 CA--C 1.586 2.364 0 C-N-CA 124.78 1.232 . . . . 0.0 113.437 -174.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -53.58 -27.05 39.6 Favored 'Trans proline' 0 CA--C 1.571 2.374 0 N-CA-C 120.744 3.325 . . . . 0.0 120.744 176.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 75.23 106.89 0.08 Allowed 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 125.667 1.587 . . . . 0.0 113.47 174.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -127.16 68.89 0.53 Allowed Glycine 0 N--CA 1.494 2.539 0 O-C-N 121.556 -0.715 . . . . 0.0 113.876 173.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 48.8 mm -111.44 80.37 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -178.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.551 HD12 ' H ' ' A' ' 9' ' ' ILE 0.413 2.6 pp 50.23 -100.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.343 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 -179.345 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.551 ' H ' HD12 ' A' ' 8' ' ' ILE . 19.6 pt -115.23 177.17 2.0 Allowed 'Isoleucine or valine' 0 CA--C 1.576 1.965 0 CA-C-N 120.92 1.691 . . . . 0.0 112.623 -178.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.375 0.0 OUTLIER 80.81 80.91 0.04 OUTLIER 'General case' 0 CA--C 1.584 2.254 0 C-N-CA 126.54 1.936 . . . . 0.0 111.944 -177.758 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.86 158.97 38.74 Favored 'General case' 0 CA--C 1.573 1.858 0 CA-C-O 122.989 1.376 . . . . 0.0 111.786 173.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -80.47 165.33 22.28 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.097 -1.627 . . . . 0.0 114.456 -174.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.89 123.69 26.1 Favored 'General case' 0 CA--C 1.574 1.887 0 O-C-N 121.44 -0.787 . . . . 0.0 111.036 -179.217 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 129.0 2.37 5.62 Favored Glycine 0 CA--C 1.557 2.677 0 N-CA-C 117.371 1.708 . . . . 0.0 117.371 -173.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -121.71 155.49 35.1 Favored 'General case' 0 CA--C 1.572 1.801 0 CA-C-N 119.895 1.847 . . . . 0.0 112.0 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.4 tt -71.19 137.64 48.89 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -174.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -125.59 176.43 6.87 Favored 'General case' 0 CA--C 1.571 1.78 0 N-CA-C 115.459 1.651 . . . . 0.0 115.459 -174.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.4 mp -110.11 -75.85 0.62 Allowed 'General case' 0 CA--C 1.577 1.993 0 N-CA-C 104.463 -2.421 . . . . 0.0 104.463 169.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -96.19 -178.65 4.39 Favored 'General case' 0 CA--C 1.584 2.264 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 172.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.8 m -86.82 -19.49 28.91 Favored 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 116.617 2.081 . . . . 0.0 116.617 174.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.33 13.91 1.07 Allowed 'General case' 0 CA--C 1.578 2.051 0 N-CA-C 117.539 2.422 . . . . 0.0 117.539 174.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -95.22 -27.25 15.61 Favored 'General case' 0 CA--C 1.568 1.641 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.2 m -80.44 166.72 20.97 Favored 'General case' 0 CA--C 1.58 2.113 0 CA-C-N 120.875 1.671 . . . . 0.0 113.803 177.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.9 mtpp -67.65 -59.77 3.07 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.432 -1.417 . . . . 0.0 108.358 172.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.2 p -82.74 100.13 10.08 Favored 'General case' 0 CA--C 1.57 1.718 0 N-CA-C 102.891 -3.003 . . . . 0.0 102.891 168.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -68.5 79.72 0.27 Allowed 'General case' 0 N--CA 1.498 1.972 0 CA-C-O 125.232 2.444 . . . . 0.0 116.233 -171.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 t -146.23 95.88 2.69 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-N 111.646 -2.525 . . . . 0.0 110.188 -174.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.3 t -93.95 123.75 37.52 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 107.138 -1.431 . . . . 0.0 107.138 171.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -76.35 149.16 37.04 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 122.784 1.278 . . . . 0.0 110.427 174.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.422 ' CE1' ' H ' ' A' ' 32' ' ' THR . 0.3 OUTLIER -61.24 155.5 20.83 Favored 'General case' 0 CA--C 1.574 1.873 1 N-CA-C 129.105 6.706 . . . . 0.0 129.105 -170.664 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -100.71 -34.34 9.89 Favored 'General case' 0 CA--C 1.578 2.024 0 CA-C-N 110.215 -3.175 . . . . 0.0 119.367 173.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.422 ' H ' ' CE1' ' A' ' 30' ' ' HIS . 0.3 OUTLIER -89.19 -55.43 3.68 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.415 -1.428 . . . . 0.0 113.79 -172.488 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 9.2 pt -76.81 -52.68 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.265 0 CA-C-N 120.48 1.491 . . . . 0.0 110.893 173.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.3 tt -95.88 118.72 33.06 Favored 'General case' 0 CA--C 1.565 1.555 0 N-CA-C 103.544 -2.762 . . . . 0.0 103.544 171.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.4 p -91.21 61.74 4.58 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 118.726 2.861 . . . . 0.0 118.726 -172.494 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.7 tp -173.72 110.48 0.17 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 174.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.2 m -91.11 122.05 33.42 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 121.026 1.739 . . . . 0.0 111.72 -174.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -136.48 147.38 47.13 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-N 114.31 -1.314 . . . . 0.0 111.55 -172.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 89.4 m -65.49 135.58 55.34 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 118.278 -2.764 . . . . 0.0 111.357 174.068 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -134.02 -176.7 4.27 Favored 'General case' 0 CA--C 1.566 1.575 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -173.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -91.51 162.02 14.72 Favored 'General case' 0 CA--C 1.573 1.857 0 CA-C-O 122.524 1.155 . . . . 0.0 113.745 177.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -81.83 153.07 26.61 Favored 'General case' 0 CA--C 1.572 1.816 0 CA-C-O 121.529 0.681 . . . . 0.0 112.354 174.095 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.49 158.84 28.5 Favored 'General case' 0 CA--C 1.567 1.631 0 N-CA-C 115.332 1.604 . . . . 0.0 115.332 -176.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -118.21 174.2 6.36 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 114.383 -1.28 . . . . 0.0 111.897 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -48.96 133.96 17.48 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 116.795 2.146 . . . . 0.0 116.795 -172.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.9 m120 71.57 15.47 6.06 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 -174.496 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.1 t -113.7 152.61 30.23 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 120.778 -1.201 . . . . 0.0 111.766 174.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -64.72 136.9 57.44 Favored 'General case' 0 CA--C 1.568 1.64 0 CA-C-O 123.313 1.53 . . . . 0.0 112.777 174.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.434 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 24.6 p -136.26 143.25 44.16 Favored 'General case' 0 CA--C 1.562 1.409 0 CA-C-N 112.911 -1.95 . . . . 0.0 112.241 -177.266 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 72.5 m -77.83 99.53 5.97 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-O 122.098 0.952 . . . . 0.0 108.787 177.166 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -75.74 -47.14 27.24 Favored 'General case' 0 CA--C 1.567 1.626 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 -173.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -79.17 -40.27 31.3 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 176.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.2 p 58.96 164.18 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.091 0 CA-C-O 124.332 2.015 . . . . 0.0 114.367 -174.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.74 -166.53 1.73 Allowed 'General case' 0 CA--C 1.566 1.561 0 CA-C-O 123.466 1.603 . . . . 0.0 108.916 173.291 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -96.16 68.37 2.66 Favored 'General case' 0 CA--C 1.576 1.96 0 N-CA-C 104.962 -2.236 . . . . 0.0 104.962 171.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 178.0 -165.75 35.45 Favored Glycine 0 N--CA 1.484 1.887 0 N-CA-C 116.474 1.35 . . . . 0.0 116.474 -173.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 2.8 t -77.89 146.62 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 CA-C-O 122.257 1.027 . . . . 0.0 111.594 -171.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -110.34 137.01 48.64 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -172.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -61.44 -52.54 64.12 Favored 'General case' 0 CA--C 1.579 2.085 0 CA-C-N 114.075 -1.42 . . . . 0.0 111.846 173.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -140.71 109.08 5.83 Favored 'General case' 0 CA--C 1.566 1.578 0 N-CA-C 104.084 -2.562 . . . . 0.0 104.084 173.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 42.8 m -48.94 156.89 0.85 Allowed Pre-proline 0 CA--C 1.587 2.393 0 N-CA-C 118.027 2.602 . . . . 0.0 118.027 -177.276 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -60.25 170.84 3.64 Favored 'Trans proline' 0 CA--C 1.573 2.43 0 C-N-CA 122.678 2.252 . . . . 0.0 116.179 177.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 62.5 m -73.16 149.72 42.74 Favored 'General case' 0 CA--C 1.571 1.773 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -70.48 171.98 9.21 Favored 'General case' 0 CA--C 1.577 2.003 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 -58.94 112.95 1.85 Allowed 'General case' 0 CA--C 1.576 1.967 0 O-C-N 120.551 -1.343 . . . . 0.0 113.388 -177.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 112.84 -21.9 17.55 Favored Glycine 0 N--CA 1.496 2.659 0 N-CA-C 117.751 1.86 . . . . 0.0 117.751 -173.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.7 mp -111.5 148.75 32.5 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 119.521 1.66 . . . . 0.0 111.718 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.89 153.19 23.88 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 122.22 1.01 . . . . 0.0 113.106 -177.469 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 7.4 t -95.21 123.95 38.98 Favored 'General case' 0 CA--C 1.569 1.678 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.529 173.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -93.72 74.54 4.3 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 119.936 -1.727 . . . . 0.0 111.404 178.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -66.83 77.1 0.15 Allowed Glycine 0 N--CA 1.495 2.581 0 N-CA-C 119.968 2.747 . . . . 0.0 119.968 -173.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -109.58 -73.63 0.68 Allowed 'General case' 0 CA--C 1.57 1.746 0 CA-C-N 114.286 -0.957 . . . . 0.0 110.879 -178.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -158.26 139.97 13.75 Favored 'General case' 0 CA--C 1.566 1.581 0 C-N-CA 124.258 1.023 . . . . 0.0 109.569 -178.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 91.6 p -107.72 -54.53 2.48 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 179.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -139.73 -102.06 0.16 Allowed 'General case' 0 N--CA 1.494 1.771 0 CA-C-N 121.598 1.999 . . . . 0.0 110.185 174.466 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.0 p -130.34 -10.0 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.274 0 N-CA-C 116.938 2.199 . . . . 0.0 116.938 -174.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.48 -53.32 4.36 Favored Glycine 0 N--CA 1.493 2.46 0 N-CA-C 117.529 1.772 . . . . 0.0 117.529 -178.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.4 t -54.52 -51.41 65.24 Favored 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 115.995 1.85 . . . . 0.0 115.995 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.8 pp -92.32 35.08 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 CA-C-O 122.774 1.273 . . . . 0.0 113.775 172.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.286 11.5 p 67.9 -172.4 0.19 Allowed 'General case' 0 CA--C 1.576 1.963 0 C-N-CA 126.535 1.934 . . . . 0.0 112.261 -173.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 35.4 t30 65.06 82.8 0.18 Allowed 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 107.427 -1.324 . . . . 0.0 107.427 -174.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 36.3 p -96.8 -108.96 0.16 Allowed 'General case' 0 CA--C 1.568 1.67 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.132 -169.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -105.43 61.17 0.67 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.916 -1.115 . . . . 0.0 111.578 -176.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -99.55 146.71 26.11 Favored 'General case' 0 CA--C 1.56 1.354 0 CA-C-O 122.337 1.065 . . . . 0.0 109.894 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -98.22 -178.7 32.94 Favored Glycine 0 N--CA 1.485 1.921 0 N-CA-C 115.456 0.943 . . . . 0.0 115.456 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 32.9 mm -108.9 140.9 25.75 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 171.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.434 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 57.8 m -69.7 124.47 24.05 Favored 'General case' 0 CA--C 1.566 1.561 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 174.404 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 78.8 m-70 -144.69 155.75 43.74 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 122.805 1.288 . . . . 0.0 112.19 175.189 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -96.58 139.07 33.2 Favored 'General case' 0 CA--C 1.567 1.603 0 O-C-N 121.096 -1.003 . . . . 0.0 111.208 175.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 47.3 t -122.03 78.24 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 CA-C-O 122.675 1.226 . . . . 0.0 108.447 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 177.27 58.69 0.07 OUTLIER Glycine 0 N--CA 1.49 2.256 0 N-CA-C 115.493 0.957 . . . . 0.0 115.493 178.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -83.07 73.25 10.07 Favored 'General case' 0 CA--C 1.574 1.886 0 CA-C-O 122.939 1.352 . . . . 0.0 113.917 -176.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.0 t . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 124.081 1.896 . . . . 0.0 114.077 -176.359 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 78.3 t . . . . . 0 CA--C 1.583 2.225 0 CA-C-O 115.389 -2.243 . . . . 0.0 112.145 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -58.87 -38.53 87.9 Favored 'Trans proline' 0 CA--C 1.569 2.236 0 CA-C-N 126.276 3.277 . . . . 0.0 119.111 -179.035 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -115.36 79.23 6.73 Favored Pre-proline 0 CA--C 1.58 2.123 0 CA-C-O 118.197 -0.906 . . . . 0.0 112.249 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -74.07 -25.92 13.43 Favored 'Trans proline' 0 CA--C 1.572 2.408 0 N-CA-C 118.794 2.575 . . . . 0.0 118.794 -178.148 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 68.9 ttt180 70.56 101.98 0.06 Allowed 'General case' 0 N--CA 1.498 1.964 0 C-N-CA 125.34 1.456 . . . . 0.0 113.075 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -79.86 74.63 2.26 Favored Glycine 0 N--CA 1.496 2.648 0 O-C-N 120.797 -1.19 . . . . 0.0 115.765 176.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 10.0 tt -81.38 -7.05 10.4 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.186 0 N-CA-C 118.873 2.916 . . . . 0.0 118.873 -171.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 39.9 mt 81.62 116.87 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.504 0 C-N-CA 125.545 1.538 . . . . 0.0 107.055 -174.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.1 pt -96.13 140.38 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.979 0 CA-C-O 123.249 1.5 . . . . 0.0 112.888 -173.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -153.1 43.48 0.62 Allowed 'General case' 0 CA--C 1.58 2.104 0 N-CA-C 117.01 2.226 . . . . 0.0 117.01 -174.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.8 tp -107.16 127.42 53.49 Favored 'General case' 0 CA--C 1.575 1.918 0 O-C-N 118.96 -2.337 . . . . 0.0 112.502 -175.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -81.03 172.13 14.11 Favored 'General case' 0 CA--C 1.575 1.922 0 O-C-N 119.702 -1.874 . . . . 0.0 114.522 179.354 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -67.37 143.7 56.2 Favored 'General case' 0 CA--C 1.569 1.674 0 C-N-CA 123.973 0.909 . . . . 0.0 112.006 176.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 98.33 -1.8 59.02 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 117.352 1.701 . . . . 0.0 117.352 -173.223 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -112.36 149.26 32.73 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-N 118.943 1.372 . . . . 0.0 111.701 -178.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.4 tp -70.67 130.25 41.27 Favored 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -177.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 22.0 p -132.38 150.58 52.13 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.93 0.892 . . . . 0.0 112.79 -178.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.1 tp -84.29 -78.62 0.23 Allowed 'General case' 0 CA--C 1.57 1.728 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 172.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 -94.71 170.19 9.63 Favored 'General case' 0 CA--C 1.57 1.747 0 CA-C-N 120.012 1.278 . . . . 0.0 113.684 174.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.2 p -69.62 -15.33 63.18 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 171.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.6 40.96 0.31 Allowed 'General case' 0 CA--C 1.575 1.919 0 N-CA-C 116.467 2.025 . . . . 0.0 116.467 174.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -136.15 -40.76 0.66 Allowed 'General case' 0 CA--C 1.573 1.845 0 C-N-CA 125.954 1.702 . . . . 0.0 113.08 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 74.2 m -84.64 152.22 23.95 Favored 'General case' 0 CA--C 1.567 1.605 0 N-CA-C 115.837 1.792 . . . . 0.0 115.837 -178.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -59.92 -55.88 28.65 Favored 'General case' 0 N--CA 1.503 2.209 0 C-N-CA 124.55 1.14 . . . . 0.0 109.896 173.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.6 m -82.27 102.1 10.96 Favored 'General case' 0 CA--C 1.569 1.686 0 N-CA-C 102.58 -3.119 . . . . 0.0 102.58 168.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -71.03 78.26 0.66 Allowed 'General case' 0 CA--C 1.569 1.697 0 CA-C-O 124.095 1.902 . . . . 0.0 114.583 -171.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 47.0 t -152.6 97.78 2.29 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-N 113.338 -1.756 . . . . 0.0 111.538 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 13.5 t -83.82 111.38 19.15 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 104.979 -2.23 . . . . 0.0 104.979 171.388 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.6 124.63 40.65 Favored 'General case' 0 CA--C 1.557 1.238 0 CA-C-O 122.472 1.129 . . . . 0.0 111.642 -172.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 -80.33 137.58 36.59 Favored 'General case' 0 CA--C 1.568 1.664 0 CA-C-O 122.698 1.237 . . . . 0.0 113.905 -174.122 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -63.98 -24.91 67.9 Favored 'General case' 0 CA--C 1.58 2.127 0 N-CA-C 117.5 2.407 . . . . 0.0 117.5 173.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.334 40.3 p 124.33 95.97 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 128.991 2.916 . . . . 0.0 108.496 174.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.414 7.5 tp 56.64 -49.11 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 N-CA-C 118.751 2.871 . . . . 0.0 118.751 177.669 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.6 tp -78.87 90.37 4.71 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 122.102 2.228 . . . . 0.0 108.522 173.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.3 p -52.51 103.95 0.08 Allowed 'General case' 0 CA--C 1.575 1.912 1 N-CA-C 122.514 4.265 . . . . 0.0 122.514 -171.247 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.0 tp -146.3 83.05 1.61 Allowed 'General case' 0 CA--C 1.572 1.799 0 N-CA-C 101.772 -3.418 . . . . 0.0 101.772 171.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.8 m -98.14 144.58 27.46 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -171.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.9 ttp180 -134.09 138.8 45.52 Favored 'General case' 0 CA--C 1.567 1.602 0 C-N-CA 124.372 1.069 . . . . 0.0 110.16 -175.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 65.1 m -68.04 144.87 54.92 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 119.694 -1.879 . . . . 0.0 114.017 177.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.75 172.81 12.18 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-N 113.416 -1.72 . . . . 0.0 114.381 -173.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 33.2 tp -81.71 143.79 31.6 Favored 'General case' 0 CA--C 1.567 1.626 0 CA-C-O 122.411 1.1 . . . . 0.0 113.196 -175.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.1 ptpt -66.2 145.53 55.68 Favored 'General case' 0 CA--C 1.574 1.874 0 CA-C-O 122.033 0.921 . . . . 0.0 113.271 174.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.13 159.75 29.53 Favored 'General case' 0 CA--C 1.569 1.682 0 N-CA-C 117.681 2.474 . . . . 0.0 117.681 -172.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.9 mtt180 -124.65 170.72 10.68 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 112.876 -1.966 . . . . 0.0 111.528 -177.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -45.34 125.87 5.93 Favored 'General case' 0 CA--C 1.571 1.78 0 N-CA-C 116.555 2.057 . . . . 0.0 116.555 -174.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 75.68 18.27 2.21 Favored 'General case' 0 N--CA 1.506 2.353 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -173.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.8 t -110.27 149.15 30.58 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 120.356 -1.465 . . . . 0.0 112.392 175.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -71.76 119.81 16.47 Favored 'General case' 0 CA--C 1.57 1.749 0 C-N-CA 124.799 1.24 . . . . 0.0 111.28 -179.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.436 ' SG ' ' HA ' ' A' ' 62' ' ' PRO . 0.6 OUTLIER -123.87 154.35 39.78 Favored 'General case' 0 CA--C 1.564 1.499 0 CA-C-O 123.305 1.526 . . . . 0.0 114.427 -174.621 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.3 t -93.65 109.55 21.18 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 171.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.0 10.13 3.11 Favored 'General case' 0 CA--C 1.582 2.203 0 N-CA-C 118.325 2.713 . . . . 0.0 118.325 -179.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 44.4 p90 -143.69 160.44 40.7 Favored 'General case' 0 CA--C 1.57 1.718 0 C-N-CA 126.47 1.908 . . . . 0.0 111.076 -173.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.7 p -131.2 136.52 48.34 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 122.675 1.226 . . . . 0.0 109.637 172.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -99.78 -136.74 0.3 Allowed 'General case' 0 CA--C 1.566 1.577 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 173.305 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -128.18 74.12 1.52 Allowed 'General case' 0 CA--C 1.568 1.667 0 N-CA-C 103.414 -2.81 . . . . 0.0 103.414 170.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 161.33 -146.2 11.94 Favored Glycine 0 N--CA 1.488 2.11 0 N-CA-C 117.294 1.678 . . . . 0.0 117.294 -175.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.0 t -91.35 147.18 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 CA-C-O 122.92 1.343 . . . . 0.0 112.52 -166.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -119.86 137.13 54.19 Favored 'General case' 0 CA--C 1.556 1.208 0 CA-C-O 122.349 1.071 . . . . 0.0 110.787 -174.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -76.08 -9.74 58.86 Favored 'General case' 0 CA--C 1.582 2.196 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 174.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 11.3 ptpt -163.91 125.01 2.26 Favored 'General case' 0 CA--C 1.567 1.608 0 N-CA-C 105.965 -1.865 . . . . 0.0 105.965 175.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 64.0 m -62.67 144.01 96.34 Favored Pre-proline 0 CA--C 1.589 2.474 0 N-CA-C 117.123 2.268 . . . . 0.0 117.123 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.436 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 77.5 Cg_exo -56.93 170.44 1.45 Allowed 'Trans proline' 0 CA--C 1.575 2.552 0 C-N-CA 123.067 2.511 . . . . 0.0 117.148 174.009 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 60.3 m -77.18 163.68 26.34 Favored 'General case' 0 CA--C 1.578 2.045 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -74.63 173.03 11.01 Favored 'General case' 0 CA--C 1.578 2.036 0 N-CA-C 117.351 2.352 . . . . 0.0 117.351 -175.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 53.1 tpt85 -66.94 113.47 4.99 Favored 'General case' 0 CA--C 1.571 1.756 0 O-C-N 120.524 -1.36 . . . . 0.0 111.6 174.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.63 -0.3 59.51 Favored Glycine 0 N--CA 1.499 2.841 0 N-CA-C 118.262 2.065 . . . . 0.0 118.262 -173.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.9 tt -135.79 132.81 37.2 Favored 'General case' 0 CA--C 1.568 1.671 0 CA-C-N 119.401 1.6 . . . . 0.0 107.742 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.32 159.85 14.73 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 116.445 2.017 . . . . 0.0 116.445 -171.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.9 t -93.11 127.62 38.72 Favored 'General case' 0 CA--C 1.57 1.747 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.653 173.247 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -97.96 78.64 2.56 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 119.813 -1.804 . . . . 0.0 110.329 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -70.44 71.56 0.64 Allowed Glycine 0 N--CA 1.496 2.675 0 N-CA-C 118.999 2.359 . . . . 0.0 118.999 -174.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -112.47 -67.79 0.97 Allowed 'General case' 0 CA--C 1.57 1.731 0 C-N-CA 123.853 0.861 . . . . 0.0 110.364 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt -163.25 136.24 5.54 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 124.088 0.955 . . . . 0.0 109.286 174.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.6 t -141.61 96.01 2.91 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.672 -1.267 . . . . 0.0 109.816 178.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 30.0 tp 66.31 101.59 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 125.392 1.477 . . . . 0.0 113.503 177.302 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 86.0 t -63.32 -40.49 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.352 0 N-CA-C 114.73 1.382 . . . . 0.0 114.73 -178.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -87.45 26.24 7.36 Favored Glycine 0 N--CA 1.495 2.571 0 N-CA-C 119.864 2.706 . . . . 0.0 119.864 175.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 87.9 p -87.27 57.78 4.64 Favored 'General case' 0 N--CA 1.497 1.906 0 CA-C-N 120.675 2.238 . . . . 0.0 113.331 174.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.376 13.7 pt 59.53 -61.71 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.514 2.758 0 C-N-CA 126.543 1.937 . . . . 0.0 114.316 -173.533 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 38.9 p -118.46 156.82 28.37 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 122.849 1.309 . . . . 0.0 109.785 173.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -147.36 90.66 1.89 Allowed 'General case' 0 CA--C 1.562 1.412 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . 0.276 2.5 t -104.08 -95.69 0.32 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 123.613 0.765 . . . . 0.0 109.025 -177.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -126.34 71.22 1.26 Allowed 'General case' 0 N--CA 1.493 1.713 0 CA-C-N 120.531 1.514 . . . . 0.0 109.805 174.272 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -98.69 150.86 21.35 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 122.741 1.258 . . . . 0.0 110.392 177.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -142.02 -171.21 12.9 Favored Glycine 0 N--CA 1.48 1.58 0 CA-C-N 115.351 -0.841 . . . . 0.0 115.194 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 32.3 mm -114.4 137.24 48.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 174.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 64.5 m -67.87 125.95 27.9 Favored 'General case' 0 CA--C 1.568 1.637 0 O-C-N 120.903 -1.123 . . . . 0.0 113.349 174.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -143.22 156.97 44.87 Favored 'General case' 0 CA--C 1.561 1.394 0 CA-C-O 123.43 1.585 . . . . 0.0 111.662 175.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -98.23 108.55 21.28 Favored 'General case' 0 CA--C 1.563 1.478 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 174.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.6 p -95.69 68.44 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 CA-C-O 123.579 1.656 . . . . 0.0 111.81 -174.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.02 54.91 4.61 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 117.677 1.831 . . . . 0.0 117.677 -177.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . 0.323 4.9 ptm180 45.02 -106.54 0.11 Allowed 'General case' 0 CA--C 1.579 2.077 0 N-CA-C 116.248 1.944 . . . . 0.0 116.248 -179.286 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 10.3 t . . . . . 0 N--CA 1.498 1.952 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 176.36 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 74.7 t . . . . . 0 CA--C 1.581 2.161 0 CA-C-O 115.914 -1.993 . . . . 0.0 110.967 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -64.23 -35.25 52.9 Favored 'Trans proline' 0 CA--C 1.568 2.213 0 CA-C-N 125.828 3.117 . . . . 0.0 118.452 -175.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 50.62 71.74 1.45 Allowed Pre-proline 0 CA--C 1.589 2.476 0 N-CA-C 115.945 1.831 . . . . 0.0 115.945 174.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -81.7 75.76 4.68 Favored 'Trans proline' 0 CA--C 1.572 2.391 0 C-N-CA 122.247 1.965 . . . . 0.0 115.932 -174.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -135.85 81.19 1.87 Allowed 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.913 0.864 . . . . 0.0 108.736 175.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 160.21 109.58 0.25 Allowed Glycine 0 N--CA 1.486 2.023 0 O-C-N 121.21 -0.931 . . . . 0.0 112.119 -174.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 41.9 mm -85.93 -76.87 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 CA-C-O 119.191 -0.433 . . . . 0.0 110.1 -176.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.431 HG23 ' H ' ' A' ' 9' ' ' ILE 0.314 9.8 tp -151.02 -115.95 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 174.854 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.431 ' H ' HG23 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -99.43 -149.2 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.583 2.233 0 CA-C-N 121.075 1.761 . . . . 0.0 110.484 174.668 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 -146.57 111.21 5.22 Favored 'General case' 0 CA--C 1.573 1.848 0 O-C-N 119.031 -2.293 . . . . 0.0 113.602 -174.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 17.8 tp -96.68 96.68 8.79 Favored 'General case' 0 CA--C 1.568 1.636 0 O-C-N 120.15 -1.594 . . . . 0.0 113.442 174.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -98.24 151.68 20.21 Favored 'General case' 0 CA--C 1.578 2.026 0 N-CA-C 106.101 -1.814 . . . . 0.0 106.101 166.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -81.21 102.6 10.44 Favored 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 104.125 -2.546 . . . . 0.0 104.125 171.112 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 128.57 26.87 0.92 Allowed Glycine 0 CA--C 1.546 2.004 0 CA-C-N 113.547 -1.661 . . . . 0.0 115.669 -172.398 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -93.35 105.62 17.67 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 119.886 1.843 . . . . 0.0 108.167 172.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 mp -72.56 104.54 3.89 Favored 'General case' 0 N--CA 1.493 1.725 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 175.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 2.5 p -111.47 173.05 6.53 Favored 'General case' 0 CA--C 1.563 1.447 0 N-CA-C 117.888 2.551 . . . . 0.0 117.888 -171.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.1 tp -94.46 -73.71 0.57 Allowed 'General case' 0 CA--C 1.579 2.058 0 N-CA-C 105.965 -1.865 . . . . 0.0 105.965 170.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -100.7 -165.0 1.16 Allowed 'General case' 0 CA--C 1.583 2.249 0 C-N-CA 125.217 1.407 . . . . 0.0 113.707 172.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.1 m -93.61 -0.24 56.25 Favored 'General case' 0 N--CA 1.504 2.237 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 173.076 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.18 11.16 1.98 Allowed 'General case' 0 CA--C 1.578 2.037 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 174.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -96.2 -33.39 12.04 Favored 'General case' 0 CA--C 1.587 2.389 0 C-N-CA 125.766 1.627 . . . . 0.0 111.598 172.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . 0.305 85.0 m -87.6 131.33 34.45 Favored 'General case' 0 CA--C 1.587 2.388 0 C-N-CA 125.477 1.511 . . . . 0.0 109.674 172.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -41.33 -50.99 3.74 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 121.676 3.954 . . . . 0.0 121.676 -171.297 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 100.0 p -80.09 -77.33 0.19 Allowed 'General case' 0 CA--C 1.569 1.682 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 174.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -178.11 78.36 0.02 OUTLIER 'General case' 0 CA--C 1.571 1.752 0 N-CA-C 104.147 -2.538 . . . . 0.0 104.147 172.715 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 40.6 t -142.1 59.8 1.47 Allowed 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 116.203 1.927 . . . . 0.0 116.203 -173.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.525 ' HA ' ' SG ' ' A' ' 39' ' ' CYS . 19.3 t -92.84 119.53 32.27 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 169.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.91 115.73 31.1 Favored 'General case' 0 CA--C 1.569 1.703 0 CA-C-O 123.415 1.579 . . . . 0.0 113.745 -171.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.597 ' HB2' HG12 ' A' ' 57' ' ' VAL . 0.3 OUTLIER -87.91 118.04 27.18 Favored 'General case' 0 CA--C 1.565 1.55 0 C-N-CA 124.775 1.23 . . . . 0.0 111.201 -178.448 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -83.76 44.2 0.97 Allowed 'General case' 0 CA--C 1.584 2.255 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 176.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.412 0.7 OUTLIER 106.54 176.65 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.699 0 C-N-CA 128.842 2.857 . . . . 0.0 112.167 -174.808 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 28.1 mm -54.07 -67.54 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.527 0 O-C-N 119.532 -1.98 . . . . 0.0 115.296 -173.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 pp -97.68 49.97 1.04 Allowed 'General case' 0 N--CA 1.509 2.486 0 CA-C-N 120.517 1.508 . . . . 0.0 113.451 176.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.2 p -102.33 -3.52 27.02 Favored 'General case' 0 N--CA 1.492 1.663 1 N-CA-C 121.906 4.039 . . . . 0.0 121.906 -172.319 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 21.7 tp 70.6 120.16 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.174 0 CA-C-N 120.288 1.403 . . . . 0.0 109.566 -173.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.615 ' HB3' HG11 ' A' ' 57' ' ' VAL . 50.7 m -94.78 124.63 38.93 Favored 'General case' 0 CA--C 1.561 1.386 0 O-C-N 120.377 -1.452 . . . . 0.0 114.741 -172.322 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.3 ttt85 -132.1 134.21 45.2 Favored 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 124.43 1.092 . . . . 0.0 110.283 -175.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.525 ' SG ' ' HA ' ' A' ' 28' ' ' CYS . 89.3 m -70.35 151.04 45.68 Favored 'General case' 0 CA--C 1.56 1.355 0 O-C-N 119.511 -1.993 . . . . 0.0 114.224 177.265 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.29 -174.21 3.88 Favored 'General case' 0 CA--C 1.565 1.531 0 CA-C-N 113.031 -1.895 . . . . 0.0 113.374 -173.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.5 mt -79.58 149.4 31.39 Favored 'General case' 0 CA--C 1.57 1.737 0 CA-C-O 122.225 1.012 . . . . 0.0 112.191 175.022 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -69.35 153.25 43.89 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 175.081 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.07 151.51 40.15 Favored 'General case' 0 CA--C 1.57 1.743 0 CA-C-O 124.242 1.972 . . . . 0.0 113.941 -174.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -118.99 168.41 10.83 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-N 113.427 -1.715 . . . . 0.0 110.968 -175.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -53.1 120.9 6.47 Favored 'General case' 0 CA--C 1.571 1.774 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -173.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 79.48 25.53 0.42 Allowed 'General case' 0 N--CA 1.505 2.317 0 C-N-CA 125.439 1.496 . . . . 0.0 113.789 -172.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.7 t -126.61 154.1 44.42 Favored 'General case' 0 CA--C 1.567 1.618 0 O-C-N 120.378 -1.451 . . . . 0.0 110.492 174.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -64.59 130.84 45.19 Favored 'General case' 0 CA--C 1.574 1.883 0 N-CA-C 116.764 2.135 . . . . 0.0 116.764 -173.297 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.55 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 24.5 p -141.04 141.99 34.25 Favored 'General case' 0 CA--C 1.563 1.47 0 CA-C-N 113.112 -1.858 . . . . 0.0 113.099 177.732 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.5 t -87.01 134.39 33.49 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 170.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.43 -26.16 62.63 Favored 'General case' 0 CA--C 1.578 2.027 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 -177.454 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -127.46 157.37 40.24 Favored 'General case' 0 CA--C 1.572 1.801 0 C-N-CA 125.448 1.499 . . . . 0.0 107.897 172.005 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 17.6 p -129.24 160.46 32.88 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 124.146 1.927 . . . . 0.0 110.308 172.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.288 0.7 OUTLIER -96.49 -121.99 0.12 Allowed 'General case' 0 CA--C 1.575 1.917 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 174.347 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.37 3.15 2.56 Favored 'General case' 0 CA--C 1.589 2.452 0 O-C-N 119.62 -1.925 . . . . 0.0 112.622 171.406 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -99.85 -162.12 28.83 Favored Glycine 0 N--CA 1.481 1.675 0 O-C-N 120.557 -1.339 . . . . 0.0 113.403 -175.078 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.615 HG11 ' HB3' ' A' ' 37' ' ' SER . 4.9 t -79.41 137.42 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 CA-C-O 123.093 1.425 . . . . 0.0 109.86 -175.788 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -111.58 140.25 46.35 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -171.363 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -71.99 -1.73 15.62 Favored 'General case' 0 CA--C 1.587 2.389 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 174.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.3 123.62 0.97 Allowed 'General case' 0 CA--C 1.574 1.883 0 C-N-CA 127.879 2.472 . . . . 0.0 107.104 -174.329 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 36.2 m -70.73 129.07 90.27 Favored Pre-proline 0 CA--C 1.594 2.661 0 O-C-N 118.973 -2.33 . . . . 0.0 111.032 173.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -76.41 76.5 3.91 Favored 'Trans proline' 0 CA--C 1.573 2.427 0 N-CA-C 119.236 2.745 . . . . 0.0 119.236 -172.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 58.5 m 60.4 145.39 0.01 OUTLIER 'General case' 0 CA--C 1.578 2.041 0 N-CA-C 116.998 2.222 . . . . 0.0 116.998 174.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -65.78 162.01 19.65 Favored 'General case' 0 CA--C 1.578 2.038 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 174.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -63.02 109.28 1.43 Allowed 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.768 -1.207 . . . . 0.0 112.503 -177.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 112.92 -23.39 14.57 Favored Glycine 0 N--CA 1.498 2.812 0 N-CA-C 117.606 1.802 . . . . 0.0 117.606 -173.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.3 tp -99.1 143.22 29.62 Favored 'General case' 0 CA--C 1.572 1.79 0 CA-C-N 118.509 1.154 . . . . 0.0 111.625 -178.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -98.54 159.11 15.17 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.472 -1.393 . . . . 0.0 114.087 -174.565 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 10.4 t -93.8 123.7 37.31 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.687 172.291 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -96.2 121.8 38.36 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.711 -1.243 . . . . 0.0 108.782 176.266 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -70.58 64.49 0.83 Allowed Glycine 0 N--CA 1.497 2.72 0 N-CA-C 119.702 2.641 . . . . 0.0 119.702 -174.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -84.94 79.54 9.6 Favored 'General case' 0 CA--C 1.571 1.773 0 C-N-CA 124.085 0.954 . . . . 0.0 110.679 177.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt 67.19 163.23 0.19 Allowed 'General case' 0 N--CA 1.502 2.147 0 CA-C-O 123.117 1.437 . . . . 0.0 114.635 -176.438 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 28.7 m -156.31 -78.29 0.09 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.181 -1.574 . . . . 0.0 109.404 174.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -89.8 65.97 6.91 Favored 'General case' 0 CA--C 1.576 1.958 0 O-C-N 120.403 -1.436 . . . . 0.0 112.55 -177.297 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.5 p -92.0 -15.28 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.294 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 -178.199 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -148.99 -71.61 0.01 OUTLIER Glycine 0 N--CA 1.493 2.464 0 O-C-N 120.592 -1.318 . . . . 0.0 114.603 178.169 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 61.1 m -91.89 157.76 16.67 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 121.818 0.818 . . . . 0.0 112.849 174.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.5 pp -79.72 98.13 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.157 0 N-CA-C 104.825 -2.287 . . . . 0.0 104.825 173.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.275 16.7 p 69.58 163.26 0.24 Allowed 'General case' 0 CA--C 1.579 2.091 0 C-N-CA 125.261 1.424 . . . . 0.0 111.085 -170.753 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.1 t30 56.78 63.8 1.84 Allowed 'General case' 0 N--CA 1.514 2.742 0 O-C-N 119.791 -1.818 . . . . 0.0 108.71 -172.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . 0.313 1.6 t -136.23 -111.86 0.19 Allowed 'General case' 0 CA--C 1.568 1.672 0 C-N-CA 123.757 0.823 . . . . 0.0 110.484 -168.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -150.42 113.26 4.77 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 178.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -109.32 176.62 5.02 Favored 'General case' 0 CA--C 1.571 1.786 0 CA-C-O 122.027 0.918 . . . . 0.0 112.883 -172.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.65 -179.2 3.23 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 118.518 2.167 . . . . 0.0 118.518 178.398 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 39.3 mm -126.32 139.2 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.283 -1.128 . . . . 0.0 110.461 -174.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.55 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 59.7 m -69.11 128.35 36.33 Favored 'General case' 0 CA--C 1.57 1.717 0 O-C-N 120.291 -1.506 . . . . 0.0 114.464 174.546 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -141.7 158.99 43.13 Favored 'General case' 0 CA--C 1.565 1.547 0 CA-C-O 123.309 1.528 . . . . 0.0 111.922 175.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -97.65 128.14 44.13 Favored 'General case' 0 CA--C 1.562 1.433 0 CA-C-O 122.669 1.223 . . . . 0.0 111.385 178.199 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 12.3 p -146.42 74.41 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 CA-C-O 123.044 1.402 . . . . 0.0 109.093 177.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 157.16 -57.07 0.38 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 117.039 1.575 . . . . 0.0 117.039 -175.08 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 -76.14 -76.5 0.16 Allowed 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 118.54 1.17 . . . . 0.0 113.681 -172.392 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 95.9 p . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 124.294 1.997 . . . . 0.0 112.188 -179.766 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 8.9 p . . . . . 0 CA--C 1.587 2.379 0 CA-C-O 114.337 -2.744 . . . . 0.0 116.67 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -63.86 89.56 0.15 Allowed 'Trans proline' 0 CA--C 1.573 2.442 0 CA-C-N 127.344 3.658 . . . . 0.0 116.51 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -146.97 129.34 7.71 Favored Pre-proline 0 CA--C 1.58 2.106 0 CA-C-O 117.696 -1.145 . . . . 0.0 109.199 -175.008 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -75.67 77.82 3.24 Favored 'Trans proline' 0 CA--C 1.573 2.442 0 C-N-CA 122.753 2.302 . . . . 0.0 116.124 -174.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 72.5 mtm180 -100.87 -1.56 34.37 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 -177.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 89.45 -69.95 2.47 Favored Glycine 0 N--CA 1.494 2.522 0 CA-C-N 121.082 1.764 . . . . 0.0 115.617 -179.317 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 62.2 mt -91.61 82.08 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 176.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 63.0 mt -103.67 101.04 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.461 HG12 ' H ' ' A' ' 10' ' ' ASN . 0.1 OUTLIER -97.95 -69.12 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -175.166 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.461 ' H ' HG12 ' A' ' 9' ' ' ILE 0.3 0.5 OUTLIER 53.48 76.26 0.22 Allowed 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 116.952 2.204 . . . . 0.0 116.952 177.937 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.5 tp -129.77 126.21 37.62 Favored 'General case' 0 CA--C 1.574 1.895 0 C-N-CA 124.49 1.116 . . . . 0.0 108.934 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -80.31 167.34 20.38 Favored 'General case' 0 CA--C 1.573 1.862 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -174.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -63.72 138.15 58.37 Favored 'General case' 0 CA--C 1.572 1.815 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -176.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.81 -11.33 38.25 Favored Glycine 0 N--CA 1.496 2.653 0 N-CA-C 118.391 2.116 . . . . 0.0 118.391 -175.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 82.3 mm-40 -100.21 137.42 38.67 Favored 'General case' 0 CA--C 1.564 1.506 0 CA-C-N 118.99 1.395 . . . . 0.0 111.081 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 77.7 mt -67.45 134.3 51.14 Favored 'General case' 0 CA--C 1.573 1.853 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -174.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.5 p -122.97 177.84 5.32 Favored 'General case' 0 CA--C 1.573 1.849 0 CA-C-O 123.029 1.395 . . . . 0.0 113.408 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.9 mt -109.45 -74.41 0.66 Allowed 'General case' 0 CA--C 1.574 1.889 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 171.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.1 p30 -91.39 -173.23 3.53 Favored 'General case' 0 CA--C 1.581 2.154 0 C-N-CA 124.607 1.163 . . . . 0.0 113.181 172.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.8 t -94.4 -4.94 47.49 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 116.921 2.193 . . . . 0.0 116.921 174.127 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.44 1.87 15.24 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 117.382 2.364 . . . . 0.0 117.382 174.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -95.27 -20.92 18.78 Favored 'General case' 0 CA--C 1.57 1.717 0 N-CA-C 115.966 1.839 . . . . 0.0 115.966 -175.018 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.0 m -81.44 -131.72 0.03 OUTLIER 'General case' 0 CA--C 1.579 2.074 0 CA-C-N 121.236 1.834 . . . . 0.0 114.124 -175.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -72.73 -82.8 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.354 0 O-C-N 119.423 -2.048 . . . . 0.0 111.328 -177.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.6 p -88.79 -63.07 1.35 Allowed 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 121.966 0.889 . . . . 0.0 110.744 172.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -170.05 84.81 0.12 Allowed 'General case' 0 CA--C 1.569 1.706 0 N-CA-C 105.159 -2.163 . . . . 0.0 105.159 178.206 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.414 ' SG ' ' HB3' ' A' ' 40' ' ' ALA . 41.9 t -155.32 94.44 1.61 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 119.825 -1.797 . . . . 0.0 115.118 -176.724 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.513 ' HB3' HG13 ' A' ' 57' ' ' VAL . 9.8 t -114.81 139.39 49.77 Favored 'General case' 0 CA--C 1.56 1.364 0 CA-C-O 121.759 0.79 . . . . 0.0 108.988 171.708 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.46 124.61 29.06 Favored 'General case' 0 CA--C 1.573 1.837 0 CA-C-O 122.106 0.955 . . . . 0.0 109.124 174.367 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.71 ' HA ' ' CG1' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -27.45 4.93 0.0 OUTLIER 'General case' 0 CA--C 1.592 2.586 3 N-CA-C 142.845 11.794 . . . . 0.0 142.845 -166.852 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . 0.261 1.3 p30 -24.65 72.49 0.0 OUTLIER 'General case' 0 N--CA 1.531 3.592 2 CA-C-N 131.633 6.56 . . . . 0.0 125.005 -167.732 . . . . . . . . 3 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.4 t -139.85 14.74 2.49 Favored 'General case' 0 CA--C 1.583 2.235 0 CA-C-N 114.05 -1.432 . . . . 0.0 113.957 173.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.0 pt -140.12 -59.04 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 CA-C-N 120.054 1.297 . . . . 0.0 111.535 174.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 93.8 mt -131.86 -68.22 0.65 Allowed 'General case' 0 N--CA 1.498 1.936 0 CA-C-N 120.513 1.506 . . . . 0.0 113.171 -174.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.7 p -90.01 163.95 14.71 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 -174.369 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.6 tp -66.98 163.02 20.71 Favored 'General case' 0 CA--C 1.584 2.282 0 O-C-N 121.517 -0.739 . . . . 0.0 111.9 173.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.1 m -91.96 127.62 37.5 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 119.885 -1.759 . . . . 0.0 111.732 -172.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -111.66 154.51 24.82 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.86 174.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 55.7 m -63.57 151.5 41.35 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 118.751 -2.468 . . . . 0.0 112.099 174.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.414 ' HB3' ' SG ' ' A' ' 27' ' ' CYS 0.275 . . -133.82 -172.64 3.03 Favored 'General case' 0 CA--C 1.567 1.612 0 CA-C-N 113.123 -1.853 . . . . 0.0 110.663 -175.88 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 94.4 mt -125.0 150.42 46.72 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.856 -1.152 . . . . 0.0 112.008 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -63.9 144.03 57.39 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.383 -0.823 . . . . 0.0 111.456 173.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.96 147.03 35.13 Favored 'General case' 0 CA--C 1.566 1.586 0 CA-C-O 124.678 2.18 . . . . 0.0 116.246 -173.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -101.56 170.27 8.3 Favored 'General case' 0 CA--C 1.56 1.336 0 CA-C-N 111.449 -2.614 . . . . 0.0 111.161 -178.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -59.26 124.26 19.4 Favored 'General case' 0 CA--C 1.57 1.741 0 O-C-N 120.84 -1.162 . . . . 0.0 112.851 -175.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 83.21 22.01 0.17 Allowed 'General case' 0 N--CA 1.506 2.359 0 C-N-CA 125.602 1.561 . . . . 0.0 113.859 -172.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.4 t -121.28 150.1 41.91 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.059 -1.651 . . . . 0.0 111.657 174.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -69.08 141.7 54.66 Favored 'General case' 0 CA--C 1.57 1.713 0 CA-C-O 123.305 1.526 . . . . 0.0 113.391 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 8.5 p -140.33 148.81 41.91 Favored 'General case' 0 CA--C 1.564 1.514 0 CA-C-N 113.127 -1.851 . . . . 0.0 113.387 -175.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.5 p -77.26 110.51 12.03 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 120.878 -1.138 . . . . 0.0 108.421 173.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -76.3 20.23 0.22 Allowed 'General case' 0 CA--C 1.576 1.963 0 N-CA-C 120.46 3.504 . . . . 0.0 120.46 -172.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -158.1 -56.47 0.07 Allowed 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 124.869 1.268 . . . . 0.0 113.348 -174.358 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.8 p 72.29 147.12 0.08 Allowed 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 127.607 2.363 . . . . 0.0 113.702 -174.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -100.06 -139.24 0.32 Allowed 'General case' 0 CA--C 1.576 1.956 0 CA-C-N 113.143 -1.844 . . . . 0.0 107.04 172.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -136.78 68.82 1.42 Allowed 'General case' 0 CA--C 1.567 1.625 0 CA-C-O 123.796 1.76 . . . . 0.0 107.921 169.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -177.66 -156.96 17.52 Favored Glycine 0 CA--C 1.544 1.858 0 CA-C-N 113.781 -1.554 . . . . 0.0 111.522 -176.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.71 ' CG1' ' HA ' ' A' ' 30' ' ' HIS . 1.2 t -75.17 154.47 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.213 0 O-C-N 121.283 -1.127 . . . . 0.0 112.928 -171.003 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -123.11 139.1 54.41 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 116.581 2.067 . . . . 0.0 116.581 -171.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -68.71 -38.88 80.59 Favored 'General case' 0 N--CA 1.502 2.128 0 N-CA-C 113.853 1.056 . . . . 0.0 113.853 172.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -143.01 109.14 5.24 Favored 'General case' 0 CA--C 1.563 1.479 0 N-CA-C 104.381 -2.451 . . . . 0.0 104.381 174.236 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 49.2 m -52.23 150.81 7.88 Favored Pre-proline 0 CA--C 1.588 2.415 0 N-CA-C 116.085 1.883 . . . . 0.0 116.085 178.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -63.25 166.28 15.21 Favored 'Trans proline' 0 CA--C 1.572 2.385 0 C-N-CA 122.308 2.005 . . . . 0.0 115.924 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 80.3 m -69.2 150.73 47.16 Favored 'General case' 0 CA--C 1.572 1.805 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 178.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -71.24 163.47 27.58 Favored 'General case' 0 CA--C 1.573 1.857 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 174.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -54.55 118.55 4.26 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 -174.243 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.04 -29.49 9.66 Favored Glycine 0 CA--C 1.556 2.648 0 CA-C-N 114.153 -1.385 . . . . 0.0 115.851 -172.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.9 mp -99.57 144.11 29.05 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-O 122.77 1.271 . . . . 0.0 112.115 -177.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -112.16 159.14 18.84 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 124.16 0.984 . . . . 0.0 112.607 -177.079 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 3.0 t -88.83 80.79 7.08 Favored 'General case' 0 CA--C 1.575 1.926 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 177.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -100.14 103.41 14.9 Favored 'General case' 0 CA--C 1.569 1.675 0 O-C-N 120.932 -1.105 . . . . 0.0 113.307 -174.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 174.36 -103.98 0.19 Allowed Glycine 0 N--CA 1.49 2.288 0 O-C-N 120.519 -1.363 . . . . 0.0 113.726 174.448 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -94.24 132.42 38.83 Favored 'General case' 0 CA--C 1.57 1.731 0 CA-C-O 122.535 1.16 . . . . 0.0 111.098 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -75.12 113.13 12.11 Favored 'General case' 0 CA--C 1.567 1.629 0 O-C-N 121.383 -0.823 . . . . 0.0 113.104 -174.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 50.9 m -73.07 -10.64 60.0 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 119.693 3.219 . . . . 0.0 119.693 -174.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.6 mp -81.53 71.88 8.55 Favored 'General case' 0 CA--C 1.575 1.924 0 CA-C-N 121.098 1.772 . . . . 0.0 111.783 178.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 79.0 t -120.83 -60.5 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 C-N-CA 123.789 0.836 . . . . 0.0 110.18 -177.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -136.15 54.02 0.74 Allowed Glycine 0 N--CA 1.494 2.565 0 N-CA-C 116.652 1.421 . . . . 0.0 116.652 177.667 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 70.5 m 49.56 -106.54 0.21 Allowed 'General case' 0 N--CA 1.503 2.177 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 176.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.4 pp -98.01 63.0 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 CA-C-O 123.776 1.75 . . . . 0.0 113.444 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 17.3 p -130.04 154.56 47.3 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 122.903 1.335 . . . . 0.0 112.208 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -83.47 73.04 10.23 Favored 'General case' 0 CA--C 1.574 1.889 0 CA-C-O 122.36 1.076 . . . . 0.0 110.069 174.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.6 t -106.56 -67.18 0.95 Allowed 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 115.226 1.565 . . . . 0.0 115.226 -172.644 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 -143.17 128.3 18.63 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.108 0.963 . . . . 0.0 109.545 -174.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -136.77 144.46 43.78 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-O 122.495 1.14 . . . . 0.0 111.977 178.526 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -78.74 163.92 50.1 Favored Glycine 0 N--CA 1.489 2.205 0 CA-C-N 115.762 -0.654 . . . . 0.0 114.595 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 35.2 mm -103.63 132.57 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 69.6 m -62.14 119.75 9.56 Favored 'General case' 0 CA--C 1.564 1.502 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 176.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -143.99 154.1 42.93 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-O 122.324 1.059 . . . . 0.0 110.82 175.336 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -92.89 87.51 5.83 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 123.761 1.744 . . . . 0.0 110.374 -174.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.4 t -127.22 87.58 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 CA-C-N 113.165 -1.834 . . . . 0.0 107.001 -174.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -50.42 -39.88 37.47 Favored Glycine 0 N--CA 1.5 2.963 0 N-CA-C 119.932 2.733 . . . . 0.0 119.932 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 56.5 ttp180 -81.81 84.88 6.74 Favored 'General case' 0 CA--C 1.574 1.894 0 CA-C-N 118.381 1.09 . . . . 0.0 110.542 169.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.501 2.079 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 -179.159 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 15.1 m . . . . . 0 CA--C 1.579 2.063 0 CA-C-O 118.721 -0.657 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -55.26 -33.06 83.43 Favored 'Trans proline' 0 CA--C 1.573 2.435 0 N-CA-C 118.523 2.47 . . . . 0.0 118.523 174.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 p30 -104.2 107.37 57.13 Favored Pre-proline 0 CA--C 1.578 2.056 0 CA-C-O 117.331 -1.319 . . . . 0.0 109.813 174.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -56.85 -42.74 61.38 Favored 'Trans proline' 0 CA--C 1.569 2.238 0 N-CA-C 119.079 2.684 . . . . 0.0 119.079 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 71.6 -54.02 0.68 Allowed 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -80.92 56.28 4.8 Favored Glycine 0 N--CA 1.496 2.68 0 N-CA-C 118.654 2.222 . . . . 0.0 118.654 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 50.7 mm -124.01 -74.94 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 176.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.8 tp -154.59 134.11 3.67 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.798 0 O-C-N 120.977 -1.077 . . . . 0.0 109.43 176.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.6 pt -97.46 -123.75 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.586 2.342 0 O-C-N 121.397 -0.814 . . . . 0.0 109.718 174.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 71.7 m-80 58.15 74.78 0.41 Allowed 'General case' 0 CA--C 1.582 2.205 0 N-CA-C 118.015 2.598 . . . . 0.0 118.015 177.173 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 48.6 tp -103.27 142.82 33.54 Favored 'General case' 0 CA--C 1.58 2.107 0 O-C-N 119.734 -1.854 . . . . 0.0 109.178 173.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.86 179.68 7.7 Favored 'General case' 0 CA--C 1.572 1.798 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -174.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -74.4 168.47 19.63 Favored 'General case' 0 CA--C 1.575 1.916 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.97 13.63 74.28 Favored Glycine 0 CA--C 1.561 2.929 0 N-CA-C 117.13 1.612 . . . . 0.0 117.13 -172.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -117.91 143.27 46.48 Favored 'General case' 0 CA--C 1.567 1.609 0 C-N-CA 125.21 1.404 . . . . 0.0 110.504 -173.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.3 tt -71.94 131.11 42.5 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.872 -1.143 . . . . 0.0 111.271 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.54 ' SG ' ' O ' ' A' ' 19' ' ' ASN . 0.4 OUTLIER -135.96 154.25 51.16 Favored 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -173.751 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.5 mt -100.72 -67.56 0.85 Allowed 'General case' 0 CA--C 1.576 1.969 0 CA-C-N 113.622 -1.626 . . . . 0.0 108.983 171.519 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.54 ' O ' ' SG ' ' A' ' 17' ' ' CYS . 62.1 m-20 -108.18 -171.58 1.89 Allowed 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 120.776 1.625 . . . . 0.0 114.894 173.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.7 m -64.61 -30.69 71.71 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 118.92 -2.363 . . . . 0.0 113.769 172.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.31 43.34 1.01 Allowed 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 116.112 1.893 . . . . 0.0 116.112 173.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -117.7 -71.12 0.75 Allowed 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 102.281 -3.229 . . . . 0.0 102.281 171.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 34.7 m -84.89 81.04 9.06 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 103.437 -2.801 . . . . 0.0 103.437 167.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.7 mttm -66.76 5.92 0.56 Allowed 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 120.164 3.394 . . . . 0.0 120.164 -169.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.6 p -73.22 -72.93 0.23 Allowed 'General case' 0 CA--C 1.572 1.792 0 CA-C-O 118.613 -0.708 . . . . 0.0 109.14 171.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -166.68 14.44 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 115.981 1.845 . . . . 0.0 115.981 174.353 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 42.7 t -153.83 94.3 1.75 Allowed 'General case' 0 N--CA 1.499 2.019 0 CA-C-N 123.874 3.034 . . . . 0.0 117.973 -171.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.453 ' SG ' HG22 ' A' ' 57' ' ' VAL . 50.8 t -94.65 105.21 17.15 Favored 'General case' 0 CA--C 1.563 1.447 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 170.093 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.54 130.95 45.11 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 123.141 1.448 . . . . 0.0 112.824 -173.012 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 35.5 t60 -81.9 159.48 23.65 Favored 'General case' 0 CA--C 1.564 1.505 0 CA-C-O 122.815 1.293 . . . . 0.0 114.145 -174.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.3 p-10 -79.92 -51.42 9.12 Favored 'General case' 0 CA--C 1.57 1.717 0 CA-C-O 118.47 -0.776 . . . . 0.0 112.287 173.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -177.95 -65.37 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 124.589 1.156 . . . . 0.0 110.693 173.385 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 38.2 mm -133.01 -61.37 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 CA-C-N 121.042 1.746 . . . . 0.0 109.578 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.0 tp -71.06 102.4 2.45 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 120.192 1.36 . . . . 0.0 110.519 176.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 60.5 p -53.34 92.12 0.01 OUTLIER 'General case' 0 CA--C 1.573 1.856 1 N-CA-C 122.168 4.136 . . . . 0.0 122.168 -171.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 tt -125.5 87.03 2.63 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 101.865 -3.383 . . . . 0.0 101.865 171.011 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.7 m -99.98 136.39 39.96 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 -171.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -121.76 141.58 51.05 Favored 'General case' 0 CA--C 1.565 1.557 0 CA-C-N 114.707 -1.133 . . . . 0.0 108.347 174.523 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.7 m -79.55 146.31 32.69 Favored 'General case' 0 CA--C 1.556 1.174 0 O-C-N 119.492 -2.005 . . . . 0.0 113.831 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -135.64 -178.21 5.02 Favored 'General case' 0 CA--C 1.566 1.572 0 CA-C-N 113.841 -1.527 . . . . 0.0 113.996 -173.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.48 135.45 33.34 Favored 'General case' 0 CA--C 1.571 1.77 0 O-C-N 121.252 -0.905 . . . . 0.0 110.177 176.104 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.43 160.36 27.61 Favored 'General case' 0 CA--C 1.579 2.06 0 O-C-N 120.908 -1.12 . . . . 0.0 113.236 176.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.41 155.25 36.56 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 117.069 2.248 . . . . 0.0 117.069 -173.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 -117.18 175.77 5.45 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-N 112.889 -1.959 . . . . 0.0 110.696 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -58.38 128.1 35.45 Favored 'General case' 0 CA--C 1.57 1.748 0 O-C-N 120.651 -1.28 . . . . 0.0 113.631 -174.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 82.5 11.06 0.61 Allowed 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 125.748 1.619 . . . . 0.0 114.217 -173.007 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.7 t -110.36 147.16 34.5 Favored 'General case' 0 CA--C 1.563 1.458 0 O-C-N 120.143 -1.598 . . . . 0.0 111.988 175.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -80.11 110.56 15.63 Favored 'General case' 0 CA--C 1.57 1.734 0 CA-C-O 123.114 1.435 . . . . 0.0 112.449 -177.085 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.2 152.29 20.06 Favored 'General case' 0 CA--C 1.563 1.456 0 C-N-CA 125.926 1.69 . . . . 0.0 112.464 174.713 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.5 t -79.46 103.08 9.13 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 171.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.96 -38.51 69.76 Favored 'General case' 0 CA--C 1.566 1.562 0 N-CA-C 118.413 2.745 . . . . 0.0 118.413 -171.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.4 p90 -80.94 61.38 4.52 Favored 'General case' 0 CA--C 1.571 1.779 0 C-N-CA 124.728 1.211 . . . . 0.0 113.132 175.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.9 p -68.95 135.26 50.69 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 119.005 -2.309 . . . . 0.0 112.581 -174.373 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.307 0.5 OUTLIER -94.87 -135.32 0.2 Allowed 'General case' 0 CA--C 1.565 1.556 0 CA-C-N 111.551 -2.568 . . . . 0.0 107.272 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -139.45 73.57 1.44 Allowed 'General case' 0 CA--C 1.561 1.38 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 169.302 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -172.98 -140.6 3.2 Favored Glycine 0 N--CA 1.482 1.756 0 CA-C-N 115.3 -0.864 . . . . 0.0 113.333 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.453 HG22 ' SG ' ' A' ' 28' ' ' CYS . 3.4 t -87.56 142.98 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 CA-C-O 122.89 1.329 . . . . 0.0 111.139 -178.223 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -117.85 132.66 56.41 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-O 122.515 1.15 . . . . 0.0 110.353 -174.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -62.21 -43.68 98.28 Favored 'General case' 0 CA--C 1.581 2.148 0 CA-C-N 115.604 -0.725 . . . . 0.0 112.913 174.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -137.1 110.91 8.15 Favored 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 103.46 -2.793 . . . . 0.0 103.46 172.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 51.3 m -51.4 152.68 4.26 Favored Pre-proline 0 CA--C 1.593 2.605 0 N-CA-C 116.911 2.189 . . . . 0.0 116.911 -176.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.62 -173.8 0.4 Allowed 'Trans proline' 0 CA--C 1.572 2.407 0 C-N-CA 122.851 2.368 . . . . 0.0 116.619 -174.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 70.2 m -80.08 155.62 27.45 Favored 'General case' 0 CA--C 1.573 1.834 0 O-C-N 120.427 -1.42 . . . . 0.0 113.56 -178.393 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.86 -178.8 2.0 Favored 'General case' 0 CA--C 1.578 2.055 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 -175.394 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.95 112.46 3.31 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.364 -1.46 . . . . 0.0 112.562 -175.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 86.55 29.26 24.77 Favored Glycine 0 CA--C 1.556 2.637 0 N-CA-C 117.435 1.734 . . . . 0.0 117.435 -173.345 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.9 tp -141.11 141.35 34.21 Favored 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 118.812 1.306 . . . . 0.0 111.083 -176.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.74 158.32 16.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.674 -1.266 . . . . 0.0 113.219 -176.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 4.3 t -91.09 95.35 10.04 Favored 'General case' 0 CA--C 1.575 1.933 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 173.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -97.63 -55.8 2.71 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 118.561 2.8 . . . . 0.0 118.561 -171.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -78.97 68.28 3.1 Favored Glycine 0 N--CA 1.497 2.728 0 N-CA-C 116.942 1.537 . . . . 0.0 116.942 -173.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -72.94 105.65 4.52 Favored 'General case' 0 CA--C 1.565 1.552 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -170.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -87.06 67.56 9.77 Favored 'General case' 0 CA--C 1.573 1.864 0 C-N-CA 123.883 0.873 . . . . 0.0 109.216 174.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 89.0 p -138.61 81.32 1.84 Allowed 'General case' 0 CA--C 1.561 1.377 0 O-C-N 121.274 -0.891 . . . . 0.0 111.963 -173.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.7 mp -97.46 74.25 2.45 Favored 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 174.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . 0.389 2.9 p 57.58 -54.45 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 N-CA-C 117.82 2.526 . . . . 0.0 117.82 -174.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -151.4 64.73 0.37 Allowed Glycine 0 N--CA 1.487 2.089 0 C-N-CA 124.244 0.926 . . . . 0.0 111.795 173.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 96.9 p -84.88 74.72 10.45 Favored 'General case' 0 CA--C 1.568 1.671 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 -171.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 21.7 mm 68.31 114.5 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.141 0 C-N-CA 125.685 1.594 . . . . 0.0 111.505 178.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.8 p 57.25 -176.79 0.06 Allowed 'General case' 0 N--CA 1.505 2.275 0 CA-C-O 123.433 1.587 . . . . 0.0 114.512 178.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -64.96 3.26 0.59 Allowed 'General case' 0 CA--C 1.587 2.391 0 N-CA-C 117.604 2.446 . . . . 0.0 117.604 172.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 75.0 p -98.79 74.03 2.04 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 124.458 2.075 . . . . 0.0 112.666 -174.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -108.83 71.56 0.78 Allowed 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 111.91 -2.404 . . . . 0.0 107.082 173.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -126.33 167.75 15.08 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 124.059 0.944 . . . . 0.0 113.443 -171.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -125.01 160.46 19.63 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 118.184 2.034 . . . . 0.0 118.184 -177.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.5 mm -91.96 129.57 42.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 O-C-N 120.989 -1.301 . . . . 0.0 109.675 -172.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.6 m -64.04 124.52 21.81 Favored 'General case' 0 CA--C 1.567 1.618 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 177.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 72.8 m-70 -143.8 161.37 38.8 Favored 'General case' 0 CA--C 1.565 1.55 0 CA-C-O 123.462 1.601 . . . . 0.0 111.988 175.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -98.08 131.47 44.45 Favored 'General case' 0 CA--C 1.563 1.448 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.145 175.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.7 t -105.61 71.08 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.039 0 CA-C-O 123.068 1.413 . . . . 0.0 108.566 -179.194 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -89.06 68.84 2.71 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 115.542 0.977 . . . . 0.0 115.542 -176.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 16.8 ptm180 -70.67 -37.94 73.71 Favored 'General case' 0 CA--C 1.574 1.899 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 -177.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 41.7 t . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 123.98 1.848 . . . . 0.0 114.298 -176.547 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 63.4 t . . . . . 0 CA--C 1.578 2.041 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -67.86 -16.74 46.29 Favored 'Trans proline' 0 CA--C 1.573 2.445 0 N-CA-C 120.208 3.118 . . . . 0.0 120.208 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -104.68 138.2 19.44 Favored Pre-proline 0 CA--C 1.582 2.18 0 CA-C-O 117.973 -1.013 . . . . 0.0 112.418 -178.535 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.41 68.6 7.95 Favored 'Trans proline' 0 CA--C 1.575 2.525 0 C-N-CA 122.524 2.15 . . . . 0.0 116.131 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 42.9 tpt85 -99.16 83.79 2.93 Favored 'General case' 0 CA--C 1.565 1.544 0 O-C-N 120.863 -1.148 . . . . 0.0 108.984 175.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 92.19 -56.02 2.84 Favored Glycine 0 N--CA 1.499 2.859 0 N-CA-C 115.339 0.896 . . . . 0.0 115.339 -174.032 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 10.4 tt -68.25 93.34 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.574 1.896 0 C-N-CA 125.693 1.597 . . . . 0.0 111.014 169.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 60.2 mt -70.3 98.99 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.282 0 CA-C-O 122.249 1.023 . . . . 0.0 110.551 -174.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 22.6 pt -116.91 -176.32 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.579 2.077 0 C-N-CA 124.325 1.05 . . . . 0.0 111.675 -177.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.25 62.5 m-80 100.06 97.42 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 C-N-CA 127.516 2.326 . . . . 0.0 110.297 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -139.98 158.15 44.53 Favored 'General case' 0 CA--C 1.573 1.841 0 CA-C-O 122.771 1.272 . . . . 0.0 110.987 173.781 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -79.69 162.13 25.39 Favored 'General case' 0 CA--C 1.566 1.588 0 N-CA-C 115.237 1.569 . . . . 0.0 115.237 -173.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -78.18 126.51 30.91 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-O 122.403 1.097 . . . . 0.0 109.741 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 114.91 19.09 6.12 Favored Glycine 0 CA--C 1.559 2.79 0 N-CA-C 116.019 1.168 . . . . 0.0 116.019 -172.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -135.08 149.97 50.16 Favored 'General case' 0 CA--C 1.569 1.693 0 CA-C-N 119.215 1.507 . . . . 0.0 111.181 -178.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mp -73.48 147.21 44.31 Favored 'General case' 0 CA--C 1.575 1.926 0 N-CA-C 114.093 1.146 . . . . 0.0 114.093 -178.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 4.0 p -135.73 -175.08 3.84 Favored 'General case' 0 CA--C 1.574 1.901 0 CA-C-O 122.767 1.27 . . . . 0.0 114.234 -174.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.5 mt -109.31 -76.96 0.6 Allowed 'General case' 0 CA--C 1.575 1.921 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 170.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.2 p30 -96.1 -178.43 4.33 Favored 'General case' 0 CA--C 1.584 2.267 0 N-CA-C 114.908 1.448 . . . . 0.0 114.908 172.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 t -85.42 -17.54 36.3 Favored 'General case' 0 N--CA 1.503 2.206 0 N-CA-C 117.358 2.355 . . . . 0.0 117.358 174.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.14 9.75 2.35 Favored 'General case' 0 CA--C 1.577 1.998 0 N-CA-C 116.771 2.138 . . . . 0.0 116.771 174.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -97.0 -31.44 12.52 Favored 'General case' 0 CA--C 1.567 1.611 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.7 m -68.7 170.48 9.31 Favored 'General case' 0 CA--C 1.581 2.171 0 CA-C-N 121.232 1.833 . . . . 0.0 113.586 174.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -65.85 -65.25 0.7 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.034 -1.666 . . . . 0.0 108.751 172.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 83.4 p -83.65 107.49 16.13 Favored 'General case' 0 CA--C 1.566 1.588 0 N-CA-C 102.866 -3.013 . . . . 0.0 102.866 168.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -66.15 79.29 0.09 Allowed 'General case' 0 N--CA 1.501 2.089 0 CA-C-O 124.746 2.212 . . . . 0.0 115.596 -171.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 36.4 t -143.19 89.77 2.13 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 112.083 -2.326 . . . . 0.0 111.22 174.302 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.2 t -86.78 114.57 23.56 Favored 'General case' 0 CA--C 1.555 1.163 0 N-CA-C 102.688 -3.079 . . . . 0.0 102.688 169.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -96.97 123.65 40.74 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-O 123.525 1.631 . . . . 0.0 112.34 -171.474 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.449 ' HB2' HG12 ' A' ' 57' ' ' VAL . 13.5 t60 -83.18 141.85 31.62 Favored 'General case' 0 CA--C 1.558 1.286 0 CA-C-N 114.079 -1.419 . . . . 0.0 113.865 -174.585 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -68.51 17.26 0.04 OUTLIER 'General case' 0 CA--C 1.586 2.353 0 N-CA-C 117.46 2.393 . . . . 0.0 117.46 172.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.263 42.8 p 65.54 65.99 0.54 Allowed 'General case' 0 N--CA 1.499 2.023 0 C-N-CA 126.103 1.761 . . . . 0.0 112.866 -177.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.336 13.4 mt 78.62 151.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.511 2.597 0 C-N-CA 125.188 1.395 . . . . 0.0 110.256 -179.1 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.8 tp 66.46 75.4 0.33 Allowed 'General case' 0 N--CA 1.51 2.571 0 O-C-N 120.197 -1.564 . . . . 0.0 108.587 -172.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.0 p -48.11 100.56 0.02 OUTLIER 'General case' 0 CA--C 1.574 1.885 1 N-CA-C 123.457 4.614 . . . . 0.0 123.457 -170.761 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 30.6 tp -132.42 82.79 2.03 Favored 'General case' 0 CA--C 1.572 1.79 0 N-CA-C 101.645 -3.465 . . . . 0.0 101.645 170.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.0 m -99.85 131.72 45.65 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 -171.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -135.48 136.12 41.02 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 123.976 0.91 . . . . 0.0 110.981 -174.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 60.6 m -63.25 136.64 57.83 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 119.873 -1.767 . . . . 0.0 112.985 176.047 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.86 179.78 6.66 Favored 'General case' 0 CA--C 1.565 1.533 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -173.336 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -76.45 164.44 25.98 Favored 'General case' 0 CA--C 1.571 1.759 0 CA-C-O 122.417 1.103 . . . . 0.0 113.962 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.91 163.14 28.59 Favored 'General case' 0 CA--C 1.567 1.612 0 N-CA-C 115.078 1.51 . . . . 0.0 115.078 179.039 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.4 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . . . -81.03 142.84 32.98 Favored 'General case' 0 CA--C 1.564 1.489 0 CA-C-O 123.822 1.772 . . . . 0.0 113.434 177.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -96.65 164.14 12.71 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-N 113.739 -1.573 . . . . 0.0 112.173 -174.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -53.98 123.97 14.14 Favored 'General case' 0 CA--C 1.571 1.772 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -174.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 84.6 18.77 0.15 Allowed 'General case' 0 N--CA 1.508 2.444 0 C-N-CA 126.056 1.742 . . . . 0.0 113.949 -172.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.9 t -119.95 150.82 39.89 Favored 'General case' 0 CA--C 1.566 1.591 0 O-C-N 120.203 -1.56 . . . . 0.0 112.211 174.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -67.13 141.14 57.51 Favored 'General case' 0 CA--C 1.57 1.738 0 CA-C-O 122.886 1.327 . . . . 0.0 114.315 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -129.44 139.09 51.74 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-N 113.861 -1.518 . . . . 0.0 112.811 -176.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.8 t -87.82 85.56 7.05 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-O 122.171 0.986 . . . . 0.0 109.981 174.132 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.48 -33.05 64.63 Favored 'General case' 0 CA--C 1.571 1.752 0 N-CA-C 119.479 3.14 . . . . 0.0 119.479 -173.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -78.8 153.93 30.31 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 125.502 1.521 . . . . 0.0 112.915 174.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.1 p -112.44 125.4 54.17 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 123.338 1.542 . . . . 0.0 109.8 172.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.513 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.7 pt? -99.64 -159.41 0.74 Allowed 'General case' 0 CA--C 1.576 1.972 0 CA-C-N 112.655 -2.066 . . . . 0.0 106.738 171.079 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -112.49 64.42 0.63 Allowed 'General case' 0 N--CA 1.5 2.049 0 O-C-N 119.634 -1.916 . . . . 0.0 106.109 171.67 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 178.89 -165.83 35.1 Favored Glycine 0 CA--C 1.542 1.757 0 CA-C-N 113.724 -1.58 . . . . 0.0 114.872 -173.198 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.449 HG12 ' HB2' ' A' ' 30' ' ' HIS . 44.4 t -92.87 156.23 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 CA-C-O 123.314 1.531 . . . . 0.0 113.171 -166.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 17.6 m-30 -106.44 140.76 38.84 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 114.797 -1.092 . . . . 0.0 113.742 -176.105 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -71.58 -59.16 2.9 Favored 'General case' 0 CA--C 1.575 1.911 0 O-C-N 121.23 -0.919 . . . . 0.0 113.051 175.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.96 119.62 30.95 Favored 'General case' 0 CA--C 1.567 1.621 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 174.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 55.1 m -49.46 153.34 1.92 Allowed Pre-proline 0 CA--C 1.588 2.432 0 N-CA-C 120.064 3.357 . . . . 0.0 120.064 -177.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -58.23 169.47 2.9 Favored 'Trans proline' 0 CA--C 1.573 2.453 0 C-N-CA 123.216 2.611 . . . . 0.0 115.573 172.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 2.7 m -94.02 107.16 19.1 Favored 'General case' 0 CA--C 1.577 1.985 0 O-C-N 120.397 -1.439 . . . . 0.0 109.19 175.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.401 0.0 OUTLIER -83.86 -63.16 1.4 Allowed 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 120.961 3.689 . . . . 0.0 120.961 -171.32 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.89 82.11 7.65 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.245 -1.535 . . . . 0.0 114.957 -173.229 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 71.24 33.26 64.85 Favored Glycine 0 N--CA 1.495 2.616 0 N-CA-C 119.339 2.495 . . . . 0.0 119.339 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.4 mp -122.33 143.98 49.29 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 122.51 1.147 . . . . 0.0 111.464 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.63 155.82 17.86 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 122.227 1.013 . . . . 0.0 112.55 177.325 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 3.5 t -94.88 86.99 4.83 Favored 'General case' 0 CA--C 1.575 1.941 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.421 175.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -96.42 110.58 22.91 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.514 -1.366 . . . . 0.0 112.98 -173.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 142.95 75.4 0.03 OUTLIER Glycine 0 N--CA 1.493 2.445 0 O-C-N 121.284 -0.885 . . . . 0.0 112.954 175.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.25 -10.31 0.03 OUTLIER 'General case' 0 CA--C 1.583 2.239 0 N-CA-C 119.785 3.254 . . . . 0.0 119.785 -178.765 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 62.55 -100.46 0.09 Allowed 'General case' 0 N--CA 1.501 2.095 0 CA-C-N 121.353 1.888 . . . . 0.0 109.026 -173.694 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 94.4 p -135.92 12.75 3.38 Favored 'General case' 0 CA--C 1.574 1.901 0 N-CA-C 115.954 1.835 . . . . 0.0 115.954 174.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.2 pp -66.79 -31.12 71.55 Favored 'General case' 0 N--CA 1.5 2.065 0 N-CA-C 117.067 2.247 . . . . 0.0 117.067 -176.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.7 p -83.83 74.53 0.98 Allowed 'Isoleucine or valine' 0 CA--C 1.577 2.005 0 CA-C-O 123.516 1.627 . . . . 0.0 110.098 174.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -163.11 88.75 0.1 Allowed Glycine 0 N--CA 1.484 1.885 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.692 -174.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.2 m -70.42 123.25 21.3 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 178.199 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.258 17.1 mt 78.91 -77.14 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 C-N-CA 124.921 1.288 . . . . 0.0 108.136 -174.568 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 3.1 p -91.91 134.32 34.89 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 122.793 1.282 . . . . 0.0 112.626 174.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.75 76.76 7.64 Favored 'General case' 0 CA--C 1.571 1.77 0 CA-C-O 122.896 1.332 . . . . 0.0 109.401 173.176 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.2 m -96.68 -14.28 22.19 Favored 'General case' 0 CA--C 1.573 1.84 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -173.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -75.05 147.2 40.87 Favored 'General case' 0 CA--C 1.57 1.734 0 CA-C-O 122.463 1.125 . . . . 0.0 110.314 173.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -131.45 149.39 52.55 Favored 'General case' 0 CA--C 1.57 1.745 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.376 179.206 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -89.95 155.24 24.42 Favored Glycine 0 N--CA 1.499 2.867 0 O-C-N 120.922 -1.111 . . . . 0.0 114.614 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 29.5 mm -94.45 130.83 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 120.232 -1.746 . . . . 0.0 110.931 -170.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.4 ' SG ' ' HB3' ' A' ' 43' ' ' ALA . 95.8 m -61.11 120.53 10.48 Favored 'General case' 0 CA--C 1.566 1.576 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 175.109 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -144.52 143.54 30.9 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 122.481 1.134 . . . . 0.0 110.617 174.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -95.67 77.32 3.28 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 124.279 1.99 . . . . 0.0 111.792 -174.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.9 m -69.41 -15.27 19.36 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.991 0 N-CA-C 117.161 2.282 . . . . 0.0 117.161 -177.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -77.61 -37.48 30.57 Favored Glycine 0 CA--C 1.552 2.4 0 N-CA-C 117.782 1.873 . . . . 0.0 117.782 174.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 35.1 ptt180 -141.49 -56.72 0.48 Allowed 'General case' 0 CA--C 1.574 1.875 0 CA-C-N 119.338 1.569 . . . . 0.0 113.765 178.019 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 124.043 1.878 . . . . 0.0 114.007 -174.405 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 95.3 t . . . . . 0 CA--C 1.578 2.039 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -81.2 74.96 5.23 Favored 'Trans proline' 0 CA--C 1.571 2.365 0 C-N-CA 122.356 2.038 . . . . 0.0 114.537 -179.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -102.9 109.28 60.98 Favored Pre-proline 0 CA--C 1.577 2.007 0 CA-C-O 117.88 -1.057 . . . . 0.0 111.069 -178.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -72.22 -11.46 26.93 Favored 'Trans proline' 0 CA--C 1.575 2.546 0 N-CA-C 118.403 2.424 . . . . 0.0 118.403 175.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 84.5 mtm180 72.13 -53.72 0.69 Allowed 'General case' 0 N--CA 1.503 2.213 0 C-N-CA 126.112 1.765 . . . . 0.0 115.671 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 97.51 56.2 1.12 Allowed Glycine 0 N--CA 1.493 2.445 0 N-CA-C 116.037 1.175 . . . . 0.0 116.037 -174.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 10.2 tp -82.48 74.43 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.574 1.885 0 C-N-CA 124.631 1.172 . . . . 0.0 111.916 -178.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 38.9 mm 80.18 138.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.389 0 C-N-CA 125.546 1.538 . . . . 0.0 109.5 -174.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 20.1 pt -92.63 144.29 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 CA-C-O 123.013 1.387 . . . . 0.0 111.355 -177.156 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 -148.29 106.22 3.71 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.285 -177.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.2 tp -154.05 118.63 4.91 Favored 'General case' 0 CA--C 1.574 1.895 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 175.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -74.04 164.82 26.14 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -173.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 mp0 -69.86 132.84 46.64 Favored 'General case' 0 CA--C 1.567 1.604 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.891 -174.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.04 -10.29 51.46 Favored Glycine 0 N--CA 1.497 2.703 0 N-CA-C 117.18 1.632 . . . . 0.0 117.18 -173.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -99.23 144.11 28.73 Favored 'General case' 0 CA--C 1.566 1.569 0 CA-C-N 118.983 1.392 . . . . 0.0 110.843 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.5 mp -67.29 136.21 54.53 Favored 'General case' 0 CA--C 1.575 1.915 0 N-CA-C 113.904 1.075 . . . . 0.0 113.904 -175.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 11.7 p -137.92 144.57 41.34 Favored 'General case' 0 CA--C 1.565 1.522 0 C-N-CA 124.034 0.934 . . . . 0.0 112.122 -177.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 78.1 mt -82.99 -66.1 0.93 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.253 -0.904 . . . . 0.0 112.155 176.177 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -98.76 165.33 11.84 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 120.002 1.274 . . . . 0.0 113.198 174.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -74.92 -13.4 60.53 Favored 'General case' 0 N--CA 1.506 2.371 0 N-CA-C 116.301 1.963 . . . . 0.0 116.301 172.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.55 30.79 0.41 Allowed 'General case' 0 CA--C 1.58 2.098 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 172.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -127.95 -23.76 3.3 Favored 'General case' 0 CA--C 1.571 1.751 0 CA-C-O 116.767 -1.587 . . . . 0.0 114.863 -175.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 57.0 m -73.31 -144.99 0.02 OUTLIER 'General case' 0 CA--C 1.587 2.402 0 CA-C-N 122.23 2.287 . . . . 0.0 113.254 176.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -83.57 -67.64 0.77 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 118.759 -2.463 . . . . 0.0 114.233 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 61.9 p -84.66 -74.21 0.4 Allowed 'General case' 0 CA--C 1.566 1.584 0 O-C-N 121.248 -0.908 . . . . 0.0 111.235 174.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.5 t-20 -172.76 77.8 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 C-N-CA 124.731 1.212 . . . . 0.0 109.521 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.8 t -160.29 98.04 1.26 Allowed 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 121.259 1.845 . . . . 0.0 115.798 173.163 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.8 t -101.11 117.43 34.99 Favored 'General case' 0 CA--C 1.562 1.405 0 N-CA-C 103.046 -2.946 . . . . 0.0 103.046 169.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 65.1 tp60 -94.94 113.09 24.76 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.363 1.065 . . . . 0.0 113.739 -173.169 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.534 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.1 t60 -81.85 135.01 35.46 Favored 'General case' 0 CA--C 1.56 1.361 0 CA-C-N 114.741 -1.118 . . . . 0.0 111.119 176.39 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.4 p-10 -73.09 -75.53 0.14 Allowed 'General case' 0 CA--C 1.574 1.885 0 CA-C-O 118.326 -0.845 . . . . 0.0 113.043 174.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.5 t -169.5 92.6 0.25 Allowed 'General case' 0 N--CA 1.502 2.142 0 CA-C-N 120.906 1.685 . . . . 0.0 111.51 -177.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.305 3.8 mp 70.65 -69.06 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 C-N-CA 125.427 1.491 . . . . 0.0 111.348 174.779 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.4 mp -69.08 109.56 4.07 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 120.304 1.411 . . . . 0.0 107.697 173.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 56.7 p -72.2 83.57 1.02 Allowed 'General case' 0 CA--C 1.567 1.617 0 N-CA-C 120.502 3.519 . . . . 0.0 120.502 -171.371 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.7 tp -104.99 81.13 1.7 Allowed 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 103.305 -2.85 . . . . 0.0 103.305 170.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 26.9 m -100.58 124.17 45.79 Favored 'General case' 0 CA--C 1.564 1.495 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -170.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 65.6 mtt85 -114.33 167.85 10.35 Favored 'General case' 0 N--CA 1.501 2.102 0 C-N-CA 124.05 0.94 . . . . 0.0 111.601 174.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 83.4 m -79.95 147.86 31.44 Favored 'General case' 0 CA--C 1.568 1.649 0 O-C-N 118.565 -2.584 . . . . 0.0 111.104 172.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.91 172.43 12.7 Favored 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 -174.451 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.1 mt -85.25 152.67 23.14 Favored 'General case' 0 CA--C 1.568 1.663 0 CA-C-O 122.2 1.0 . . . . 0.0 113.034 -178.586 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -64.88 146.31 55.08 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 178.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.91 155.11 33.05 Favored 'General case' 0 CA--C 1.564 1.504 0 CA-C-O 123.398 1.571 . . . . 0.0 114.848 -175.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -108.33 172.66 6.71 Favored 'General case' 0 CA--C 1.562 1.422 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.448 -174.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -52.7 126.72 20.78 Favored 'General case' 0 CA--C 1.572 1.814 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 -174.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 74.51 20.11 2.55 Favored 'General case' 0 N--CA 1.506 2.347 0 N-CA-C 114.858 1.429 . . . . 0.0 114.858 -173.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 37.3 t -115.41 153.37 31.18 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 120.524 -1.36 . . . . 0.0 111.188 174.514 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -64.46 136.92 57.55 Favored 'General case' 0 CA--C 1.57 1.722 0 CA-C-O 123.18 1.467 . . . . 0.0 113.017 176.085 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.463 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 17.0 p -138.19 139.96 39.56 Favored 'General case' 0 CA--C 1.559 1.312 0 CA-C-N 113.194 -1.821 . . . . 0.0 112.436 -176.026 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.1 t -75.14 90.39 2.53 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 122.991 1.377 . . . . 0.0 110.704 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.565 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . . . -76.56 -51.04 12.41 Favored 'General case' 0 CA--C 1.568 1.65 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 -173.485 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 54.0 p90 -79.25 -37.26 38.38 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 117.193 2.294 . . . . 0.0 117.193 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 80.4 p 62.84 144.04 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 127.034 2.134 . . . . 0.0 114.644 -174.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.23 -168.36 1.55 Allowed 'General case' 0 CA--C 1.567 1.632 0 CA-C-N 113.934 -1.485 . . . . 0.0 108.436 171.505 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -103.42 74.3 1.26 Allowed 'General case' 0 CA--C 1.567 1.62 0 N-CA-C 105.191 -2.152 . . . . 0.0 105.191 171.049 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 166.42 -160.18 33.68 Favored Glycine 0 N--CA 1.482 1.701 0 CA-C-O 122.388 0.993 . . . . 0.0 115.079 -174.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.534 HG12 ' HB2' ' A' ' 30' ' ' HIS . 13.3 t -83.91 143.98 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 CA-C-O 122.935 1.35 . . . . 0.0 112.32 -167.592 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -109.24 135.18 50.76 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.916 -174.087 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -74.51 -17.58 60.73 Favored 'General case' 0 CA--C 1.589 2.447 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 173.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm -147.67 119.21 7.94 Favored 'General case' 0 CA--C 1.572 1.817 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 174.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 74.4 m -55.51 151.11 21.79 Favored Pre-proline 0 CA--C 1.586 2.357 0 N-CA-C 117.366 2.358 . . . . 0.0 117.366 177.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -66.79 172.88 8.89 Favored 'Trans proline' 0 CA--C 1.576 2.61 0 C-N-CA 122.464 2.109 . . . . 0.0 115.623 174.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 34.1 m -74.7 154.67 38.34 Favored 'General case' 0 CA--C 1.579 2.065 0 O-C-N 120.63 -1.294 . . . . 0.0 114.481 -178.223 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.41 179.15 7.85 Favored 'General case' 0 CA--C 1.576 1.957 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 179.262 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -65.81 103.44 0.9 Allowed 'General case' 0 CA--C 1.572 1.813 0 O-C-N 120.49 -1.381 . . . . 0.0 113.02 -176.051 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 129.79 -45.68 1.12 Allowed Glycine 0 N--CA 1.494 2.559 0 CA-C-N 115.224 -0.898 . . . . 0.0 114.816 -173.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mp -93.75 139.44 30.84 Favored 'General case' 0 CA--C 1.562 1.411 0 CA-C-O 122.707 1.242 . . . . 0.0 111.338 -176.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.32 151.24 21.28 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 121.787 0.803 . . . . 0.0 112.414 -177.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.565 ' SG ' ' HB2' ' A' ' 51' ' ' ALA . 8.8 t -92.13 124.36 36.16 Favored 'General case' 0 CA--C 1.567 1.621 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.527 173.31 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -92.68 96.78 10.38 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.702 -1.249 . . . . 0.0 107.672 -176.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.01 39.41 0.09 OUTLIER Glycine 0 N--CA 1.497 2.741 1 N-CA-C 124.6 4.6 . . . . 0.0 124.6 -172.711 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -88.51 101.45 13.94 Favored 'General case' 0 CA--C 1.567 1.617 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 161.021 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -67.69 90.28 0.27 Allowed 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 -173.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.1 p 45.26 43.32 8.02 Favored 'General case' 0 CA--C 1.576 1.943 0 N-CA-C 118.208 2.67 . . . . 0.0 118.208 -178.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.8 mt -72.55 -27.02 61.96 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 116.044 1.868 . . . . 0.0 116.044 -175.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 67.0 t -74.41 -27.14 20.98 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.24 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 174.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -150.01 76.04 0.25 Allowed Glycine 0 N--CA 1.49 2.286 0 CA-C-N 119.815 1.188 . . . . 0.0 114.624 177.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 86.8 p -85.09 91.11 8.02 Favored 'General case' 0 CA--C 1.57 1.727 0 CA-C-O 121.378 0.609 . . . . 0.0 112.388 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 19.9 tt -137.02 -69.23 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 C-N-CA 123.676 0.79 . . . . 0.0 110.17 -178.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 26.5 p -70.47 163.56 26.54 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 120.886 -1.134 . . . . 0.0 112.417 174.392 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -76.6 59.41 1.51 Allowed 'General case' 0 CA--C 1.581 2.165 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 -178.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 41.6 p -139.08 75.2 1.5 Allowed 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 123.83 1.776 . . . . 0.0 110.119 -178.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 19.7 p-10 -84.6 77.38 10.05 Favored 'General case' 0 N--CA 1.496 1.834 0 CA-C-N 113.365 -1.743 . . . . 0.0 111.122 178.25 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -134.79 160.09 39.3 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 -172.175 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.12 -179.26 52.53 Favored Glycine 0 N--CA 1.493 2.454 0 O-C-N 121.786 -0.571 . . . . 0.0 113.677 172.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.0 mm -115.59 137.08 50.35 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.536 0 CA-C-N 119.455 1.627 . . . . 0.0 111.62 -174.68 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.463 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 57.0 m -69.56 126.83 30.92 Favored 'General case' 0 CA--C 1.569 1.696 0 O-C-N 120.813 -1.179 . . . . 0.0 114.179 174.509 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -141.33 156.05 45.88 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 122.905 1.336 . . . . 0.0 111.115 176.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -93.68 77.11 4.31 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-O 124.097 1.903 . . . . 0.0 111.629 -174.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 93.0 t -118.63 -70.3 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 CA-C-N 112.246 -2.252 . . . . 0.0 109.04 -177.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.79 96.15 0.1 Allowed Glycine 0 N--CA 1.48 1.608 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -177.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -41.72 -39.29 1.66 Allowed 'General case' 0 N--CA 1.504 2.226 0 N-CA-C 120.005 3.335 . . . . 0.0 120.005 -175.533 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 115.92 1.822 . . . . 0.0 115.92 178.13 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 95.9 t . . . . . 0 CA--C 1.583 2.248 0 CA-C-O 115.409 -2.234 . . . . 0.0 112.187 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -70.21 95.33 0.59 Allowed 'Trans proline' 0 CA--C 1.57 2.312 0 CA-C-N 126.24 3.264 . . . . 0.0 115.497 -178.129 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -107.62 107.4 60.3 Favored Pre-proline 0 CA--C 1.577 2.014 0 CA-C-O 117.771 -1.109 . . . . 0.0 110.27 178.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -69.08 86.28 0.49 Allowed 'Trans proline' 0 CA--C 1.571 2.374 0 C-N-CA 122.834 2.356 . . . . 0.0 116.104 178.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -84.93 -48.86 8.87 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -177.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 147.52 -101.08 0.23 Allowed Glycine 0 N--CA 1.484 1.845 0 O-C-N 121.091 -1.005 . . . . 0.0 112.409 176.128 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 50.1 mm -125.56 89.82 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 -177.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 16.0 tt -89.99 50.9 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.477 0 CA-C-O 122.534 1.159 . . . . 0.0 112.948 174.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.298 40.5 mm -122.15 -93.35 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.575 1.929 0 N-CA-C 104.814 -2.291 . . . . 0.0 104.814 -175.523 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 35.06 87.79 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.15 0 N-CA-C 120.844 3.646 . . . . 0.0 120.844 172.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.4 tp -127.81 127.29 43.26 Favored 'General case' 0 CA--C 1.58 2.106 0 O-C-N 120.679 -1.263 . . . . 0.0 108.985 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -76.13 158.73 31.43 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 119.961 -1.712 . . . . 0.0 114.895 -174.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.26 136.22 54.59 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 122.028 0.918 . . . . 0.0 111.216 176.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.96 -7.85 67.56 Favored Glycine 0 CA--C 1.557 2.69 0 N-CA-C 116.558 1.383 . . . . 0.0 116.558 -172.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -97.66 142.72 29.12 Favored 'General case' 0 CA--C 1.567 1.599 0 CA-C-N 119.026 1.413 . . . . 0.0 110.167 178.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.4 mp -63.99 128.09 34.28 Favored 'General case' 0 CA--C 1.573 1.835 0 CA-C-O 122.14 0.971 . . . . 0.0 112.455 -178.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -129.11 157.85 40.6 Favored 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 123.741 1.734 . . . . 0.0 113.57 -173.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.3 mt -102.76 -64.97 1.02 Allowed 'General case' 0 CA--C 1.573 1.849 0 CA-C-N 114.269 -1.332 . . . . 0.0 107.598 170.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -98.97 148.83 23.59 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.481 ' HA ' ' HB2' ' A' ' 28' ' ' CYS . 2.8 t -68.29 -22.65 64.72 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 119.819 -1.801 . . . . 0.0 112.842 169.184 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . 0.3 . . -71.68 3.4 4.09 Favored 'General case' 0 CA--C 1.58 2.121 0 N-CA-C 115.725 1.75 . . . . 0.0 115.725 171.154 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -99.83 -37.52 9.03 Favored 'General case' 0 CA--C 1.575 1.928 0 C-N-CA 126.05 1.74 . . . . 0.0 113.206 173.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 12.5 m -76.46 157.37 32.27 Favored 'General case' 0 CA--C 1.572 1.795 0 N-CA-C 116.507 2.04 . . . . 0.0 116.507 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -68.54 -59.65 2.99 Favored 'General case' 0 N--CA 1.501 2.084 0 C-N-CA 124.307 1.043 . . . . 0.0 109.016 172.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.7 t -81.52 104.38 11.9 Favored 'General case' 0 CA--C 1.565 1.534 0 N-CA-C 103.0 -2.963 . . . . 0.0 103.0 168.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -70.88 82.01 0.65 Allowed 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 124.528 2.109 . . . . 0.0 113.071 -172.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 28.8 t -155.92 81.56 1.01 Allowed 'General case' 0 CA--C 1.56 1.336 0 CA-C-N 112.157 -2.292 . . . . 0.0 109.99 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.481 ' HB2' ' HA ' ' A' ' 20' ' ' SER . 18.0 t -78.84 114.2 17.57 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 104.785 -2.302 . . . . 0.0 104.785 172.03 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -82.03 109.27 16.21 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -171.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.461 ' HB2' HG12 ' A' ' 57' ' ' VAL . 39.4 t-80 -77.35 108.37 10.44 Favored 'General case' 0 CA--C 1.564 1.489 0 CA-C-O 122.244 1.021 . . . . 0.0 111.132 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.1 p-10 -64.82 42.71 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.341 0 N-CA-C 119.115 3.005 . . . . 0.0 119.115 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.8 p 67.17 84.22 0.16 Allowed 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 126.049 1.74 . . . . 0.0 113.725 173.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.273 4.3 mp 72.49 -48.56 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 C-N-CA 125.292 1.437 . . . . 0.0 113.63 177.099 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.8 mt -51.68 -27.47 11.79 Favored 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 118.33 2.715 . . . . 0.0 118.33 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.251 28.4 p 76.73 -2.6 2.66 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 118.988 2.958 . . . . 0.0 118.988 174.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.5 mp -73.95 95.01 2.41 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 121.041 1.746 . . . . 0.0 106.735 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.6 m -96.55 158.55 15.38 Favored 'General case' 0 CA--C 1.567 1.616 0 CA-C-O 122.874 1.321 . . . . 0.0 113.961 -170.388 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -141.55 138.39 32.65 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.675 -1.265 . . . . 0.0 110.922 -178.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 67.3 m -63.22 143.48 57.76 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 118.448 -2.658 . . . . 0.0 113.721 176.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.95 171.86 13.49 Favored 'General case' 0 CA--C 1.564 1.509 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -173.013 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -108.02 149.26 28.63 Favored 'General case' 0 CA--C 1.569 1.68 0 CA-C-N 114.481 -1.236 . . . . 0.0 110.793 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -53.38 142.59 21.24 Favored 'General case' 0 CA--C 1.577 2.007 0 N-CA-C 116.372 1.99 . . . . 0.0 116.372 176.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.4 168.79 19.43 Favored 'General case' 0 CA--C 1.574 1.882 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -174.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 63.1 mtt-85 -116.44 162.86 16.91 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.011 -1.056 . . . . 0.0 112.183 -177.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -55.4 126.76 26.48 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -175.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.265 66.9 m-80 77.76 20.82 1.01 Allowed 'General case' 0 CA--C 1.584 2.254 0 C-N-CA 125.267 1.427 . . . . 0.0 114.464 -173.15 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.0 t -119.51 155.15 32.68 Favored 'General case' 0 CA--C 1.565 1.529 0 O-C-N 120.477 -1.389 . . . . 0.0 110.742 173.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -61.93 130.01 43.64 Favored 'General case' 0 CA--C 1.566 1.568 0 CA-C-O 123.21 1.481 . . . . 0.0 114.479 -176.619 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.546 ' SG ' ' HA ' ' A' ' 62' ' ' PRO . 23.4 t -133.48 145.29 50.07 Favored 'General case' 0 CA--C 1.568 1.669 0 CA-C-N 113.022 -1.899 . . . . 0.0 112.752 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.5 m -120.57 137.65 54.29 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 105.245 -2.131 . . . . 0.0 105.245 171.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -82.07 -132.32 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.144 0 O-C-N 120.512 -1.368 . . . . 0.0 113.464 -174.507 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -133.15 156.25 47.8 Favored 'General case' 0 N--CA 1.491 1.584 1 N-CA-C 125.108 5.225 . . . . 0.0 125.108 -169.086 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.351 70.3 p 63.94 128.0 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.133 1 CA-C-N 108.115 -4.129 . . . . 0.0 115.165 -178.058 . . . . . . . . 3 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.346 0.4 OUTLIER -142.85 -81.08 0.2 Allowed 'General case' 0 CA--C 1.582 2.194 1 CA-C-N 108.228 -4.078 . . . . 0.0 100.683 -173.883 . . . . . . . . 4 3 . 1 . 018 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -159.22 -16.29 0.06 Allowed 'General case' 0 CA--C 1.611 3.312 0 C-N-CA 130.194 3.398 . . . . 0.0 107.907 169.298 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 118.0 58.48 0.28 Allowed Glycine 0 CA--C 1.562 2.982 0 C-N-CA 125.373 1.463 . . . . 0.0 113.773 -170.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.461 HG12 ' HB2' ' A' ' 30' ' ' HIS . 16.9 t -145.15 141.45 22.81 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.756 0 CA-C-N 121.791 2.796 . . . . 0.0 106.088 139.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -125.8 131.29 52.49 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 120.782 -1.198 . . . . 0.0 113.686 -172.031 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -69.1 -29.66 67.79 Favored 'General case' 0 CA--C 1.579 2.059 0 N-CA-C 116.133 1.901 . . . . 0.0 116.133 179.082 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -149.56 125.32 10.46 Favored 'General case' 0 CA--C 1.57 1.736 0 N-CA-C 105.823 -1.918 . . . . 0.0 105.823 174.736 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.2 m -55.23 152.19 16.15 Favored Pre-proline 0 CA--C 1.596 2.746 0 N-CA-C 116.797 2.147 . . . . 0.0 116.797 -175.042 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.546 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 44.2 Cg_endo -78.45 37.48 0.64 Allowed 'Trans proline' 0 CA--C 1.569 2.271 1 N-CA-C 122.786 4.11 . . . . 0.0 122.786 -171.188 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.478 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 29.8 m 64.42 144.17 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 -178.656 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -66.24 145.94 55.19 Favored 'General case' 0 CA--C 1.569 1.677 0 O-C-N 119.816 -1.802 . . . . 0.0 112.961 176.064 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -62.97 119.76 10.06 Favored 'General case' 0 CA--C 1.565 1.538 0 CA-C-O 123.737 1.732 . . . . 0.0 114.628 -172.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 138.69 -48.76 0.86 Allowed Glycine 0 N--CA 1.49 2.299 0 CA-C-N 112.461 -2.154 . . . . 0.0 113.804 -172.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -105.08 173.69 6.2 Favored 'General case' 0 CA--C 1.575 1.915 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 175.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -100.64 155.1 18.07 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -173.616 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 37.3 t -96.36 127.8 42.69 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-N 113.324 -1.762 . . . . 0.0 110.895 172.278 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -97.75 151.36 20.24 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 120.728 1.604 . . . . 0.0 111.649 174.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -124.7 83.44 0.35 Allowed Glycine 0 N--CA 1.495 2.606 0 O-C-N 120.783 -1.198 . . . . 0.0 112.562 176.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -85.55 76.59 10.01 Favored 'General case' 0 CA--C 1.572 1.793 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 -170.108 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.85 71.17 0.5 Allowed 'General case' 0 N--CA 1.504 2.234 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 174.774 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 50.1 m -74.39 -51.37 15.2 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 114.843 1.423 . . . . 0.0 114.843 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.14 75.57 10.31 Favored 'General case' 0 CA--C 1.571 1.767 0 CA-C-N 119.558 1.072 . . . . 0.0 110.248 174.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.491 HG13 ' H ' ' A' ' 77' ' ' GLY 0.322 14.8 p -103.58 -106.35 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.57 1.72 0 C-N-CA 124.009 0.924 . . . . 0.0 110.069 -176.61 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.491 ' H ' HG13 ' A' ' 76' ' ' VAL . . . 179.9 82.72 0.06 OUTLIER Glycine 0 N--CA 1.488 2.165 0 O-C-N 120.699 -1.251 . . . . 0.0 115.331 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.9 t -134.88 -131.5 0.16 Allowed 'General case' 0 CA--C 1.575 1.909 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 172.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.269 0.0 OUTLIER -80.29 -65.39 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.226 0 O-C-N 120.234 -1.541 . . . . 0.0 108.527 173.431 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.4 p -116.46 135.1 54.12 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 122.895 1.331 . . . . 0.0 109.486 173.282 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 46.3 m-20 -82.43 65.68 7.68 Favored 'General case' 0 CA--C 1.573 1.858 0 CA-C-O 122.819 1.295 . . . . 0.0 113.512 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 40.6 p -125.1 75.98 1.5 Allowed 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 123.953 1.835 . . . . 0.0 109.508 177.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -123.73 98.18 5.7 Favored 'General case' 0 CA--C 1.566 1.558 0 CA-C-N 112.366 -2.197 . . . . 0.0 107.583 -177.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -107.76 161.0 15.29 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-O 122.039 0.923 . . . . 0.0 112.213 -173.317 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -86.76 -164.32 39.76 Favored Glycine 0 N--CA 1.487 2.046 0 O-C-N 121.071 -1.018 . . . . 0.0 115.457 175.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 33.9 mm -125.89 152.71 33.26 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.058 0 CA-C-O 122.882 1.325 . . . . 0.0 110.29 -174.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.457 ' SG ' ' HB2' ' A' ' 49' ' ' CYS . 58.6 m -76.11 122.09 23.77 Favored 'General case' 0 CA--C 1.57 1.722 0 O-C-N 120.312 -1.493 . . . . 0.0 112.379 172.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -138.51 143.01 39.34 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 123.414 1.578 . . . . 0.0 111.092 178.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 -98.93 137.14 37.91 Favored 'General case' 0 CA--C 1.56 1.355 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.578 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 57.9 t -110.96 -87.79 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.45 -174.029 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.57 84.86 0.36 Allowed Glycine 0 N--CA 1.493 2.46 0 N-CA-C 115.46 0.944 . . . . 0.0 115.46 -178.049 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.0 108.87 1.31 Allowed 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 117.8 0.8 . . . . 0.0 112.557 -176.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 62.2 p . . . . . 0 N--CA 1.489 1.518 0 CA-C-O 123.266 1.508 . . . . 0.0 110.497 -174.268 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 CA--C 1.577 2.005 0 CA-C-O 118.961 -0.542 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -73.51 53.32 2.63 Favored 'Trans proline' 0 CA--C 1.578 2.704 0 C-N-CA 122.712 2.275 . . . . 0.0 117.063 177.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -138.85 75.51 36.09 Favored Pre-proline 0 CA--C 1.579 2.061 0 O-C-N 120.441 -1.412 . . . . 0.0 112.683 -174.233 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -71.7 -65.09 0.03 OUTLIER 'Trans proline' 0 CA--C 1.571 2.33 0 C-N-CA 122.436 2.09 . . . . 0.0 113.878 176.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 42.0 ttp180 -99.83 75.7 1.91 Allowed 'General case' 0 CA--C 1.571 1.764 0 O-C-N 121.22 -0.925 . . . . 0.0 108.905 173.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.34 84.24 0.08 OUTLIER Glycine 0 N--CA 1.487 2.096 0 O-C-N 121.069 -1.02 . . . . 0.0 115.634 -176.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 5.1 mp -97.18 83.21 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 N-CA-C 105.679 -1.971 . . . . 0.0 105.679 171.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 21.3 pt -85.57 122.68 38.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 CA-C-O 122.338 1.066 . . . . 0.0 112.164 -174.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.9 pt -100.12 -174.52 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.582 2.204 0 C-N-CA 123.893 0.877 . . . . 0.0 111.65 177.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 94.95 86.98 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 127.382 2.273 . . . . 0.0 112.642 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -138.41 157.39 46.31 Favored 'General case' 0 CA--C 1.573 1.849 0 CA-C-O 122.664 1.221 . . . . 0.0 111.941 172.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -78.11 167.19 21.82 Favored 'General case' 0 CA--C 1.569 1.693 0 O-C-N 120.337 -1.477 . . . . 0.0 113.961 -175.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -74.82 148.32 40.38 Favored 'General case' 0 CA--C 1.578 2.02 0 CA-C-O 122.312 1.053 . . . . 0.0 110.762 174.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.52 28.2 10.74 Favored Glycine 0 CA--C 1.56 2.888 0 N-CA-C 114.979 0.752 . . . . 0.0 114.979 -171.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -139.39 146.22 39.91 Favored 'General case' 0 CA--C 1.568 1.636 0 C-N-CA 125.157 1.383 . . . . 0.0 109.698 -175.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.2 tt -69.68 119.18 13.52 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 120.657 -1.277 . . . . 0.0 111.721 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 14.6 p -120.92 158.42 27.72 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -175.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -88.64 -84.79 0.2 Allowed 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 174.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.7 p30 -94.03 169.78 10.02 Favored 'General case' 0 N--CA 1.499 2.004 0 C-N-CA 124.021 0.928 . . . . 0.0 113.11 173.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.7 m -72.03 -23.08 61.33 Favored 'General case' 0 N--CA 1.504 2.261 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 174.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.28 12.06 1.04 Allowed 'General case' 0 CA--C 1.583 2.245 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 173.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 31.3 mm100 -93.1 -47.56 6.91 Favored 'General case' 0 CA--C 1.569 1.702 0 C-N-CA 125.05 1.34 . . . . 0.0 112.737 174.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 70.9 m -72.55 154.28 40.88 Favored 'General case' 0 CA--C 1.57 1.75 0 CA-C-N 120.451 1.478 . . . . 0.0 113.705 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -54.44 -57.39 11.5 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.944 -1.097 . . . . 0.0 111.1 174.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.1 m -83.75 106.31 15.35 Favored 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 103.606 -2.739 . . . . 0.0 103.606 168.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -68.89 85.0 0.32 Allowed 'General case' 0 N--CA 1.495 1.804 0 CA-C-O 124.185 1.945 . . . . 0.0 113.718 -173.2 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.7 t -151.66 73.12 1.06 Allowed 'General case' 0 CA--C 1.564 1.497 0 CA-C-N 113.01 -1.904 . . . . 0.0 111.165 -174.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 35.9 t -79.49 113.69 17.83 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 104.482 -2.414 . . . . 0.0 104.482 171.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -100.1 112.8 25.11 Favored 'General case' 0 CA--C 1.567 1.626 0 CA-C-O 123.179 1.466 . . . . 0.0 114.656 -170.386 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.612 ' HB2' HG12 ' A' ' 57' ' ' VAL . 0.9 OUTLIER -82.46 144.66 30.3 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 126.118 1.767 . . . . 0.0 110.9 176.023 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -82.9 75.55 9.79 Favored 'General case' 0 CA--C 1.58 2.118 0 O-C-N 120.452 -1.405 . . . . 0.0 108.186 171.424 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.415 HG23 ' H ' ' A' ' 33' ' ' ILE 0.406 11.8 t 55.04 -106.63 0.34 Allowed 'General case' 0 N--CA 1.5 2.034 0 C-N-CA 126.275 1.83 . . . . 0.0 113.207 -173.293 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.415 ' H ' HG23 ' A' ' 32' ' ' THR . 0.2 OUTLIER -103.22 -18.11 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.291 0 CA-C-N 120.68 1.582 . . . . 0.0 114.042 174.256 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.1 tp -72.74 121.74 20.35 Favored 'General case' 0 CA--C 1.569 1.707 0 CA-C-N 121.24 1.836 . . . . 0.0 108.838 173.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 82.1 p -83.86 100.49 11.01 Favored 'General case' 0 CA--C 1.568 1.654 0 N-CA-C 118.823 2.897 . . . . 0.0 118.823 -171.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 38.9 tp -149.23 87.29 1.52 Allowed 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 102.63 -3.1 . . . . 0.0 102.63 171.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 m -100.3 122.16 42.64 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 -171.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -133.49 137.27 45.57 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 124.679 1.192 . . . . 0.0 109.163 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 63.4 m -66.04 142.65 57.74 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 119.501 -1.999 . . . . 0.0 113.28 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -137.69 -172.95 3.36 Favored 'General case' 0 CA--C 1.569 1.691 0 CA-C-N 113.433 -1.712 . . . . 0.0 112.754 -174.121 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 37.8 tp -90.9 150.8 21.37 Favored 'General case' 0 CA--C 1.573 1.836 0 CA-C-O 122.264 1.031 . . . . 0.0 112.457 176.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -70.38 155.31 40.86 Favored 'General case' 0 CA--C 1.574 1.866 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 173.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.46 150.63 36.67 Favored 'General case' 0 CA--C 1.571 1.762 0 CA-C-O 124.561 2.124 . . . . 0.0 114.043 -174.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -124.61 168.17 13.5 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.186 -1.824 . . . . 0.0 110.857 -175.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -54.41 133.98 45.61 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.907 -1.121 . . . . 0.0 112.616 -176.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.391 8.8 p30 67.77 17.41 9.77 Favored 'General case' 0 CA--C 1.585 2.326 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -171.965 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.1 t -118.14 153.3 34.03 Favored 'General case' 0 CA--C 1.567 1.607 0 O-C-N 120.78 -1.2 . . . . 0.0 110.253 173.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -60.01 122.67 14.9 Favored 'General case' 0 CA--C 1.572 1.802 0 N-CA-C 117.448 2.388 . . . . 0.0 117.448 -174.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.566 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 53.2 t -142.81 132.52 23.93 Favored 'General case' 0 CA--C 1.56 1.352 0 CA-C-N 113.816 -1.538 . . . . 0.0 110.848 173.226 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 27.9 t -139.69 158.74 43.6 Favored 'General case' 0 CA--C 1.568 1.666 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 172.164 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -119.13 126.36 51.42 Favored 'General case' 0 CA--C 1.571 1.751 0 CA-C-O 124.599 2.142 . . . . 0.0 112.169 -173.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 19.8 p90 -146.47 -142.16 0.12 Allowed 'General case' 0 CA--C 1.579 2.095 0 CA-C-N 111.942 -2.39 . . . . 0.0 108.324 -172.287 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.0 m -63.95 111.33 2.45 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 119.537 -1.977 . . . . 0.0 109.336 171.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.458 2.3 mt -112.1 42.16 1.82 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 117.83 2.53 . . . . 0.0 117.83 -178.76 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . 0.362 0.5 OUTLIER -153.7 29.87 0.47 Allowed 'General case' 0 CA--C 1.583 2.246 0 CA-C-N 113.353 -1.749 . . . . 0.0 112.141 166.541 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -123.18 -131.86 3.88 Favored Glycine 0 CA--C 1.548 2.155 0 N-CA-C 108.722 -1.751 . . . . 0.0 108.722 172.28 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.612 HG12 ' HB2' ' A' ' 30' ' ' HIS . 14.2 t -101.84 144.09 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.503 0 O-C-N 121.169 -1.195 . . . . 0.0 108.795 170.267 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 15.3 m-30 -114.21 136.9 52.44 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 -169.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.36 -48.6 55.59 Favored 'General case' 0 CA--C 1.578 2.048 0 O-C-N 120.886 -1.134 . . . . 0.0 112.723 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.407 ' H ' ' HE2' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -137.12 113.6 10.14 Favored 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 102.155 -3.276 . . . . 0.0 102.155 172.771 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 60.8 m -54.4 148.55 23.74 Favored Pre-proline 0 CA--C 1.587 2.387 0 N-CA-C 115.008 1.485 . . . . 0.0 115.008 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -64.74 169.06 12.12 Favored 'Trans proline' 0 CA--C 1.568 2.206 0 C-N-CA 122.384 2.056 . . . . 0.0 116.602 -173.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 83.8 m -67.72 154.03 42.41 Favored 'General case' 0 CA--C 1.572 1.824 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 -178.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.86 173.99 2.07 Favored 'General case' 0 CA--C 1.579 2.081 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -62.65 108.1 1.09 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.551 -1.343 . . . . 0.0 112.363 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 112.1 -22.51 18.21 Favored Glycine 0 N--CA 1.497 2.743 0 N-CA-C 117.749 1.859 . . . . 0.0 117.749 -173.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.9 mp -98.9 152.21 20.01 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-N 119.064 1.432 . . . . 0.0 112.531 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.3 159.49 15.21 Favored 'General case' 0 CA--C 1.564 1.487 0 CA-C-O 122.508 1.147 . . . . 0.0 112.556 177.531 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 4.9 t -89.44 96.54 10.75 Favored 'General case' 0 CA--C 1.573 1.845 0 N-CA-C 105.95 -1.87 . . . . 0.0 105.95 172.35 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -96.7 123.05 40.27 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.69 -1.256 . . . . 0.0 114.374 -171.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 79.42 61.27 2.35 Favored Glycine 0 N--CA 1.495 2.608 0 N-CA-C 115.382 0.913 . . . . 0.0 115.382 -176.107 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -83.03 83.4 7.85 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.865 0.84 . . . . 0.0 112.707 -167.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -95.53 12.44 29.51 Favored 'General case' 0 CA--C 1.575 1.906 0 N-CA-C 117.059 2.244 . . . . 0.0 117.059 -174.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 88.7 p -76.32 83.69 3.09 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-N 121.412 1.915 . . . . 0.0 111.659 -176.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.4 mt -78.24 74.76 4.78 Favored 'General case' 0 CA--C 1.566 1.596 0 CA-C-O 123.478 1.609 . . . . 0.0 114.134 -173.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 12.9 p -58.95 -36.74 63.32 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 174.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -121.26 53.76 0.69 Allowed Glycine 0 N--CA 1.493 2.444 0 N-CA-C 115.553 0.981 . . . . 0.0 115.553 174.159 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.1 t -155.37 -59.92 0.11 Allowed 'General case' 0 N--CA 1.498 1.956 0 CA-C-N 118.619 1.21 . . . . 0.0 113.684 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.295 0.2 OUTLIER -136.07 -78.99 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.492 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 5.9 p -140.35 142.98 35.52 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 123.394 1.568 . . . . 0.0 112.659 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -65.92 -20.7 66.3 Favored 'General case' 0 CA--C 1.579 2.095 0 N-CA-C 115.653 1.723 . . . . 0.0 115.653 172.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 80.7 p -96.1 69.86 2.78 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-O 125.313 2.482 . . . . 0.0 113.213 -173.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 26.3 m120 -151.96 100.7 2.67 Favored 'General case' 0 CA--C 1.56 1.359 0 CA-C-N 110.65 -2.977 . . . . 0.0 103.381 -178.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.7 m-30 -118.67 154.27 32.99 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.209 -1.557 . . . . 0.0 115.187 -172.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -94.25 -162.75 35.54 Favored Glycine 0 N--CA 1.488 2.15 0 CA-C-N 115.083 -0.962 . . . . 0.0 113.752 173.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.1 mm -135.53 142.74 38.65 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.009 0 O-C-N 121.761 -0.846 . . . . 0.0 110.537 -176.319 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.566 ' SG ' ' HB2' ' A' ' 49' ' ' CYS . 19.3 m -70.79 130.31 41.36 Favored 'General case' 0 CA--C 1.569 1.709 0 O-C-N 120.169 -1.582 . . . . 0.0 113.375 173.059 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -143.33 155.07 44.35 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 123.228 1.49 . . . . 0.0 112.439 175.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -97.95 73.99 2.29 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 122.794 1.283 . . . . 0.0 111.617 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.7 p -78.86 -54.08 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.7 -74.09 1.59 Allowed Glycine 0 N--CA 1.491 2.337 0 O-C-N 121.256 -0.902 . . . . 0.0 114.963 -176.439 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 47.6 tpt85 -90.24 85.48 6.25 Favored 'General case' 0 CA--C 1.57 1.713 0 CA-C-O 122.251 1.024 . . . . 0.0 110.984 175.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.7 t . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 124.026 1.869 . . . . 0.0 113.489 -178.266 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.257 79.8 t . . . . . 0 CA--C 1.58 2.12 0 CA-C-O 116.077 -1.916 . . . . 0.0 108.793 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -74.12 169.82 21.56 Favored 'Trans proline' 0 CA--C 1.572 2.393 0 CA-C-N 125.388 2.96 . . . . 0.0 114.9 174.27 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -108.72 83.93 2.3 Favored Pre-proline 0 CA--C 1.583 2.239 0 CA-C-O 117.638 -1.172 . . . . 0.0 111.547 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -85.7 79.95 2.01 Favored 'Trans proline' 0 CA--C 1.573 2.441 0 C-N-CA 122.678 2.252 . . . . 0.0 115.574 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -99.58 49.01 0.94 Allowed 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 177.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.38 -6.49 61.87 Favored Glycine 0 N--CA 1.501 3.026 0 N-CA-C 121.604 3.402 . . . . 0.0 121.604 -177.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 9.2 tp -68.3 -28.03 39.13 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.213 0 N-CA-C 115.598 1.703 . . . . 0.0 115.598 167.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 41.4 mm -102.34 -59.84 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 CA-C-N 119.47 1.032 . . . . 0.0 110.53 176.101 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.6 pt -98.45 139.92 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 CA-C-O 122.89 1.329 . . . . 0.0 112.159 -174.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -148.21 98.13 2.87 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 -173.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.4 tp -150.23 115.33 5.38 Favored 'General case' 0 CA--C 1.577 1.998 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 173.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -75.55 162.31 28.4 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 115.845 1.795 . . . . 0.0 115.845 -172.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.91 140.86 56.38 Favored 'General case' 0 CA--C 1.574 1.869 0 CA-C-O 122.481 1.134 . . . . 0.0 113.809 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.91 2.35 61.12 Favored Glycine 0 N--CA 1.496 2.659 0 N-CA-C 117.856 1.902 . . . . 0.0 117.856 -174.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -112.42 133.04 54.72 Favored 'General case' 0 CA--C 1.566 1.565 0 CA-C-N 118.935 1.367 . . . . 0.0 110.082 -175.027 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.9 tt -68.33 119.86 13.52 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.424 -0.797 . . . . 0.0 111.834 -176.093 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 24.7 p -128.07 158.42 38.01 Favored 'General case' 0 CA--C 1.558 1.268 0 CA-C-O 122.35 1.072 . . . . 0.0 112.798 -175.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.8 mt -92.98 -73.67 0.55 Allowed 'General case' 0 CA--C 1.568 1.664 0 O-C-N 120.835 -1.166 . . . . 0.0 108.61 173.392 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -91.94 150.75 20.85 Favored 'General case' 0 CA--C 1.569 1.674 0 N-CA-C 115.822 1.786 . . . . 0.0 115.822 178.447 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.1 m -68.56 -16.51 63.89 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 124.93 1.292 . . . . 0.0 114.162 170.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . 0.325 . . -75.03 28.64 0.09 Allowed 'General case' 0 CA--C 1.594 2.645 0 C-N-CA 126.608 1.963 . . . . 0.0 114.036 171.743 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -138.52 -39.52 0.52 Allowed 'General case' 0 CA--C 1.583 2.217 0 C-N-CA 127.731 2.413 . . . . 0.0 113.126 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.9 m -65.18 -171.67 0.08 Allowed 'General case' 0 CA--C 1.587 2.388 0 CA-C-N 121.817 2.099 . . . . 0.0 115.201 -177.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -70.12 -57.63 4.73 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 119.101 -2.249 . . . . 0.0 115.225 -175.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 36.3 m -82.37 -78.87 0.19 Allowed 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 173.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -174.49 68.95 0.03 OUTLIER 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 173.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.3 t -151.87 94.24 1.95 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 118.885 -2.385 . . . . 0.0 116.553 -174.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 26.3 t -95.63 112.61 24.29 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 101.283 -3.599 . . . . 0.0 101.283 168.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -91.7 124.06 35.56 Favored 'General case' 0 CA--C 1.562 1.421 0 CA-C-O 122.548 1.166 . . . . 0.0 113.786 -171.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.431 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.7 t60 -79.27 131.96 36.32 Favored 'General case' 0 CA--C 1.56 1.361 0 C-N-CA 125.098 1.359 . . . . 0.0 112.031 -174.585 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.83 31.29 0.09 Allowed 'General case' 0 CA--C 1.585 2.293 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.253 24.9 p 70.31 100.69 0.06 Allowed 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 126.47 1.908 . . . . 0.0 112.096 179.101 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.29 3.7 mp 72.83 -63.66 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 C-N-CA 125.477 1.511 . . . . 0.0 111.614 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.7 tp -68.26 128.89 38.21 Favored 'General case' 0 CA--C 1.571 1.755 0 CA-C-N 120.624 1.556 . . . . 0.0 110.776 174.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.9 p -86.65 31.5 0.68 Allowed 'General case' 0 CA--C 1.571 1.782 0 N-CA-C 118.954 2.946 . . . . 0.0 118.954 -173.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 31.3 tp -82.42 93.61 7.25 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 172.496 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.1 m -97.35 148.93 22.66 Favored 'General case' 0 CA--C 1.566 1.56 0 CA-C-O 123.325 1.536 . . . . 0.0 114.022 -170.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 57.2 ttm-85 -141.2 137.2 32.47 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.197 -0.939 . . . . 0.0 109.676 -176.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 58.7 m -61.07 140.09 57.94 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 119.632 -1.917 . . . . 0.0 111.896 175.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.69 178.12 7.46 Favored 'General case' 0 CA--C 1.565 1.548 0 N-CA-C 116.492 2.034 . . . . 0.0 116.492 -172.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.8 tp -86.77 149.6 24.75 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-O 122.26 1.029 . . . . 0.0 112.248 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -67.12 141.1 57.54 Favored 'General case' 0 CA--C 1.572 1.793 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 174.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.412 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . . . -75.73 162.12 28.48 Favored 'General case' 0 CA--C 1.571 1.774 0 CA-C-O 124.181 1.943 . . . . 0.0 115.173 -176.397 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -111.09 -178.81 3.56 Favored 'General case' 0 CA--C 1.567 1.61 0 CA-C-N 113.397 -1.729 . . . . 0.0 113.082 -173.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -60.0 135.34 57.68 Favored 'General case' 0 CA--C 1.568 1.648 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -176.081 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 66.72 38.14 4.0 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 124.902 1.281 . . . . 0.0 113.307 -173.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 10.9 t -128.19 140.36 51.95 Favored 'General case' 0 CA--C 1.561 1.391 0 O-C-N 121.011 -1.055 . . . . 0.0 111.991 178.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -73.06 97.05 2.27 Favored 'General case' 0 CA--C 1.572 1.793 0 C-N-CA 124.13 0.972 . . . . 0.0 112.226 178.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.16 136.48 36.57 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-O 122.117 0.961 . . . . 0.0 112.057 177.368 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 91.8 p -88.06 116.12 26.02 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 105.226 -2.139 . . . . 0.0 105.226 171.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -80.02 -117.9 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.964 0 CA-C-O 116.219 -1.848 . . . . 0.0 114.583 -172.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -130.42 154.0 48.18 Favored 'General case' 0 CA--C 1.567 1.6 1 N-CA-C 123.486 4.625 . . . . 0.0 123.486 -170.165 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.434 24.0 p 43.29 122.15 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.258 0 CA-C-N 108.4 -4.0 . . . . 0.0 116.378 -172.448 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.775 HD23 ' H ' ' A' ' 56' ' ' GLY 0.418 0.0 OUTLIER -145.54 -71.55 0.26 Allowed 'General case' 0 CA--C 1.576 1.946 1 CA-C-N 107.695 -4.32 . . . . 0.0 102.142 -173.309 . . . . . . . . 5 4 . 1 . 020 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.626 ' H ' HD23 ' A' ' 54' ' ' LEU . 52.6 t80 -158.99 -30.77 0.07 Allowed 'General case' 0 CA--C 1.591 2.55 0 C-N-CA 127.694 2.398 . . . . 0.0 110.474 171.645 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.775 ' H ' HD23 ' A' ' 54' ' ' LEU . . . 122.93 43.82 0.35 Allowed Glycine 0 CA--C 1.556 2.605 0 N-CA-C 117.436 1.735 . . . . 0.0 117.436 -172.364 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.431 HG12 ' HB2' ' A' ' 30' ' ' HIS . 11.3 t -138.84 132.68 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.422 0 CA-C-N 122.958 3.379 . . . . 0.0 106.428 145.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -117.84 132.11 56.48 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.744 -172.16 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -61.97 -42.62 99.33 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 120.038 -1.663 . . . . 0.0 115.402 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -142.76 119.27 11.0 Favored 'General case' 0 CA--C 1.562 1.408 0 N-CA-C 105.277 -2.12 . . . . 0.0 105.277 174.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 84.2 m -44.17 148.95 0.75 Allowed Pre-proline 0 CA--C 1.593 2.607 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 -176.496 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -70.05 42.23 0.36 Allowed 'Trans proline' 0 CA--C 1.574 2.519 1 N-CA-C 122.521 4.008 . . . . 0.0 122.521 -171.256 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.412 ' SG ' ' HB3' ' A' ' 43' ' ' ALA . 67.6 m 58.98 154.13 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 117.516 2.413 . . . . 0.0 117.516 175.761 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -62.27 151.83 35.31 Favored 'General case' 0 CA--C 1.573 1.837 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -179.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -68.98 104.08 2.0 Favored 'General case' 0 CA--C 1.573 1.84 0 CA-C-O 122.38 1.086 . . . . 0.0 112.324 -174.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 136.44 -29.49 2.79 Favored Glycine 0 N--CA 1.497 2.742 0 N-CA-C 116.108 1.203 . . . . 0.0 116.108 -173.006 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.5 mp -96.88 144.6 26.67 Favored 'General case' 0 CA--C 1.566 1.567 0 C-N-CA 124.372 1.069 . . . . 0.0 111.538 177.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -99.43 135.77 40.36 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 122.012 0.911 . . . . 0.0 111.567 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 30.3 t -94.99 113.89 25.64 Favored 'General case' 0 CA--C 1.568 1.641 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.669 175.392 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -92.94 81.16 4.6 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.122 -1.611 . . . . 0.0 113.319 -174.317 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -34.95 85.11 0.01 OUTLIER Glycine 0 N--CA 1.503 3.15 0 N-CA-C 121.829 3.492 . . . . 0.0 121.829 -177.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -83.36 68.43 9.69 Favored 'General case' 0 CA--C 1.577 2.003 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 -169.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 66.8 mttm 66.69 -56.98 0.4 Allowed 'General case' 0 N--CA 1.509 2.489 0 N-CA-C 118.211 2.671 . . . . 0.0 118.211 174.181 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . 0.289 66.1 m 74.44 -40.48 0.45 Allowed 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -178.471 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -17.77 62.07 Favored 'General case' 0 CA--C 1.58 2.113 0 N-CA-C 116.222 1.934 . . . . 0.0 116.222 173.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.8 p -82.46 74.12 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.578 2.027 0 CA-C-O 123.682 1.705 . . . . 0.0 112.474 178.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -154.5 85.19 0.14 Allowed Glycine 0 N--CA 1.487 2.034 0 CA-C-N 115.091 -0.959 . . . . 0.0 112.421 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 30.0 t -77.03 42.05 0.31 Allowed 'General case' 0 CA--C 1.583 2.226 0 N-CA-C 117.604 2.446 . . . . 0.0 117.604 -175.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.464 HG23 ' H ' ' A' ' 80' ' ' THR . 17.9 tt -160.02 -74.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 174.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.464 ' H ' HG23 ' A' ' 79' ' ' ILE . 3.3 p -125.44 139.76 53.36 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 122.898 1.333 . . . . 0.0 109.94 173.753 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -82.24 53.23 2.2 Favored 'General case' 0 CA--C 1.574 1.899 0 N-CA-C 115.521 1.674 . . . . 0.0 115.521 -177.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 40.3 p -103.45 71.35 1.09 Allowed 'General case' 0 N--CA 1.502 2.133 0 CA-C-O 124.966 2.317 . . . . 0.0 109.667 174.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -135.11 95.58 3.33 Favored 'General case' 0 CA--C 1.564 1.498 0 CA-C-N 111.521 -2.581 . . . . 0.0 108.057 -174.06 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -131.51 -178.34 4.81 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 120.651 -1.281 . . . . 0.0 112.49 -174.176 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -73.6 135.61 20.9 Favored Glycine 0 N--CA 1.487 2.048 0 N-CA-C 116.645 1.418 . . . . 0.0 116.645 -179.047 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.6 mm -89.76 134.15 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 CA-C-O 122.743 1.259 . . . . 0.0 109.047 -174.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 69.6 m -80.81 122.42 27.16 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -132.79 153.02 51.65 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 122.733 1.254 . . . . 0.0 110.701 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -93.61 127.14 39.14 Favored 'General case' 0 CA--C 1.56 1.36 0 CA-C-O 122.834 1.302 . . . . 0.0 110.617 -174.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.4 p -141.39 -50.03 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-N 114.124 -1.398 . . . . 0.0 113.422 -173.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 70.49 71.97 0.95 Allowed Glycine 0 N--CA 1.494 2.518 0 N-CA-C 116.397 1.319 . . . . 0.0 116.397 176.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 86.7 mtm180 71.95 -65.79 0.33 Allowed 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 124.499 1.12 . . . . 0.0 112.539 -173.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.1 m . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 125.13 2.395 . . . . 0.0 108.138 174.599 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 41.9 t . . . . . 0 CA--C 1.579 2.059 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -60.19 99.08 0.13 Allowed 'Trans proline' 0 CA--C 1.57 2.287 0 C-N-CA 123.038 2.492 . . . . 0.0 116.959 -178.933 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -112.24 96.13 33.73 Favored Pre-proline 0 CA--C 1.576 1.957 0 CA-C-O 118.162 -0.923 . . . . 0.0 109.92 -179.262 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -80.88 71.84 6.84 Favored 'Trans proline' 0 CA--C 1.57 2.29 0 C-N-CA 122.419 2.079 . . . . 0.0 114.935 -178.855 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 76.3 mtp180 -80.48 -59.27 2.76 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -176.885 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -125.11 62.2 0.59 Allowed Glycine 0 N--CA 1.495 2.623 0 O-C-N 121.428 -0.795 . . . . 0.0 115.038 174.686 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 28.8 mt -121.04 -55.17 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 C-N-CA 123.484 0.714 . . . . 0.0 110.305 -177.483 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.4 mp 61.65 66.87 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 C-N-CA 125.083 1.353 . . . . 0.0 112.706 176.412 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 36.8 pt -134.42 171.3 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 120.995 -1.066 . . . . 0.0 111.999 -178.816 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.253 69.3 m-80 97.6 89.16 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 127.339 2.255 . . . . 0.0 111.308 -179.682 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.4 ' H ' ' HA ' ' A' ' 23' ' ' CYS . 1.7 pt? -141.75 164.3 30.56 Favored 'General case' 0 CA--C 1.577 2.011 0 CA-C-O 122.519 1.152 . . . . 0.0 111.491 173.746 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -80.14 167.34 20.48 Favored 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 116.291 1.96 . . . . 0.0 116.291 -173.231 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -72.03 138.91 48.25 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.433 0.693 . . . . 0.0 110.418 175.005 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 92.83 5.84 64.14 Favored Glycine 0 CA--C 1.558 2.766 0 N-CA-C 116.23 1.252 . . . . 0.0 116.23 -172.149 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -109.09 144.38 37.2 Favored 'General case' 0 CA--C 1.567 1.611 0 CA-C-N 119.002 1.401 . . . . 0.0 109.925 174.475 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 tt -67.4 115.45 7.06 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -174.744 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.5 p -110.91 152.82 26.3 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 124.359 1.063 . . . . 0.0 113.264 179.411 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.3 mt -84.54 -78.69 0.24 Allowed 'General case' 0 CA--C 1.568 1.657 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 174.127 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -96.09 177.85 5.6 Favored 'General case' 0 CA--C 1.578 2.052 0 O-C-N 121.202 -0.936 . . . . 0.0 113.191 172.795 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.1 m -77.37 -19.37 56.32 Favored 'General case' 0 N--CA 1.504 2.25 0 N-CA-C 116.48 2.03 . . . . 0.0 116.48 174.894 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.32 17.71 0.47 Allowed 'General case' 0 CA--C 1.581 2.164 0 N-CA-C 116.655 2.095 . . . . 0.0 116.655 173.939 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -96.9 -48.87 5.26 Favored 'General case' 0 CA--C 1.57 1.723 0 C-N-CA 125.127 1.371 . . . . 0.0 114.1 -177.194 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.4 ' HA ' ' H ' ' A' ' 11' ' ' LEU . 87.9 m -81.19 170.63 15.89 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 115.965 1.839 . . . . 0.0 115.965 -177.4 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -63.06 -55.83 22.15 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 123.561 0.745 . . . . 0.0 109.283 171.531 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.4 t -82.56 100.4 10.1 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 104.166 -2.531 . . . . 0.0 104.166 169.077 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -72.67 71.86 1.01 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 125.081 2.372 . . . . 0.0 114.39 -173.642 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.411 ' SG ' ' HB3' ' A' ' 40' ' ' ALA . 2.1 t -148.02 86.19 1.56 Allowed 'General case' 0 CA--C 1.559 1.316 0 CA-C-N 112.373 -2.194 . . . . 0.0 109.513 -173.531 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.7 t -80.66 119.5 23.37 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 120.586 -1.321 . . . . 0.0 107.908 173.857 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.9 tp60 -101.42 117.51 35.08 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.542 1.137 . . . . 0.0 113.22 -172.96 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 8.4 m170 -60.73 159.59 10.69 Favored 'General case' 0 CA--C 1.567 1.603 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 177.162 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -89.91 60.37 4.92 Favored 'General case' 0 CA--C 1.578 2.04 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 171.126 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.7 m 80.96 -75.3 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.191 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 -169.06 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.0 mt -138.2 -115.25 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.584 2.253 0 N-CA-C 103.502 -2.777 . . . . 0.0 103.502 172.535 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.251 3.8 mm? 41.59 -107.89 0.09 Allowed 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 127.123 2.169 . . . . 0.0 114.806 174.56 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 89.8 p -152.1 -111.3 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.315 0 CA-C-O 116.133 -1.889 . . . . 0.0 109.709 173.27 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.0 tp 23.24 60.97 0.04 OUTLIER 'General case' 0 N--CA 1.514 2.761 0 CA-C-N 121.362 1.892 . . . . 0.0 115.683 -174.35 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 45.2 m -99.17 119.15 37.39 Favored 'General case' 0 CA--C 1.554 1.098 0 CA-C-N 114.257 -1.338 . . . . 0.0 112.298 -170.664 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -99.11 165.65 11.62 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.961 -0.462 . . . . 0.0 110.469 175.083 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 45.9 m -80.59 152.16 28.71 Favored 'General case' 0 CA--C 1.563 1.475 0 O-C-N 119.064 -2.272 . . . . 0.0 112.12 173.447 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.411 ' HB3' ' SG ' ' A' ' 27' ' ' CYS . . . -140.66 -178.76 5.67 Favored 'General case' 0 CA--C 1.569 1.675 0 CA-C-N 113.282 -1.781 . . . . 0.0 112.689 -173.915 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -88.42 137.32 32.43 Favored 'General case' 0 CA--C 1.568 1.642 0 O-C-N 121.01 -1.056 . . . . 0.0 112.571 179.629 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.97 155.42 30.8 Favored 'General case' 0 CA--C 1.576 1.979 0 CA-C-O 121.868 0.842 . . . . 0.0 110.709 172.422 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.53 156.43 27.77 Favored 'General case' 0 CA--C 1.568 1.642 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 -173.634 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 22.7 mtm180 -129.29 172.93 10.99 Favored 'General case' 0 CA--C 1.563 1.47 0 CA-C-N 112.806 -1.997 . . . . 0.0 109.761 177.558 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -48.77 130.45 17.73 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 115.62 1.711 . . . . 0.0 115.62 -173.891 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.8 m120 77.19 10.24 2.52 Favored 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 -174.182 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 30.7 t -109.26 148.75 30.48 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 120.532 1.514 . . . . 0.0 112.268 175.277 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -79.76 112.56 17.16 Favored 'General case' 0 CA--C 1.57 1.744 0 CA-C-O 123.839 1.781 . . . . 0.0 112.747 -178.346 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.97 177.4 5.44 Favored 'General case' 0 CA--C 1.571 1.772 0 CA-C-N 112.304 -2.225 . . . . 0.0 111.048 173.639 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.432 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 58.3 m -79.65 -113.03 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 104.872 -2.27 . . . . 0.0 104.872 170.017 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -160.17 -80.53 0.05 OUTLIER 'General case' 0 CA--C 1.564 1.486 0 CA-C-N 122.862 2.573 . . . . 0.0 110.788 172.272 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -77.63 -46.34 22.36 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 174.743 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.9 p 60.74 153.62 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 124.954 2.312 . . . . 0.0 116.447 -176.858 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.53 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.6 pt? -97.59 179.45 4.84 Favored 'General case' 0 CA--C 1.583 2.234 0 CA-C-N 112.71 -2.041 . . . . 0.0 108.685 171.985 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -84.76 12.84 6.54 Favored 'General case' 0 N--CA 1.514 2.743 0 O-C-N 118.422 -2.674 . . . . 0.0 114.036 174.009 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.45 ' H ' ' HG ' ' A' ' 54' ' ' LEU . . . -113.41 -152.42 11.0 Favored Glycine 0 N--CA 1.476 1.357 0 O-C-N 120.99 -1.069 . . . . 0.0 114.226 -173.831 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.5 t -78.49 142.08 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 CA-C-O 122.912 1.339 . . . . 0.0 111.314 -167.442 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -119.51 153.61 35.09 Favored 'General case' 0 CA--C 1.561 1.393 0 N-CA-C 116.468 2.025 . . . . 0.0 116.468 -171.329 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -83.03 -56.08 4.0 Favored 'General case' 0 CA--C 1.577 2.016 0 CA-C-N 113.253 -1.794 . . . . 0.0 110.077 172.964 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -133.16 108.01 8.54 Favored 'General case' 0 CA--C 1.564 1.505 0 N-CA-C 104.606 -2.368 . . . . 0.0 104.606 173.448 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.6 m -52.11 153.06 5.08 Favored Pre-proline 0 CA--C 1.584 2.259 0 N-CA-C 118.433 2.753 . . . . 0.0 118.433 -175.333 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -70.31 172.29 13.45 Favored 'Trans proline' 0 CA--C 1.568 2.204 0 C-N-CA 122.687 2.258 . . . . 0.0 115.574 -177.904 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 60.4 m -70.77 156.39 39.58 Favored 'General case' 0 CA--C 1.571 1.754 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 177.312 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.53 168.55 3.56 Favored 'General case' 0 CA--C 1.58 2.099 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 174.793 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 91.5 mtt180 -63.03 112.16 2.48 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.227 -1.546 . . . . 0.0 113.492 -175.52 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 114.42 -22.83 13.0 Favored Glycine 0 N--CA 1.495 2.622 0 N-CA-C 118.926 2.33 . . . . 0.0 118.926 -173.984 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.7 mp -99.43 143.76 29.31 Favored 'General case' 0 CA--C 1.572 1.792 0 CA-C-N 119.462 1.631 . . . . 0.0 112.877 -176.02 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -102.23 155.44 18.22 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 124.116 0.967 . . . . 0.0 113.413 -177.308 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.432 ' SG ' ' O ' ' A' ' 50' ' ' SER . 1.9 t -94.67 83.71 4.12 Favored 'General case' 0 CA--C 1.579 2.079 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 179.684 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -131.2 121.59 25.1 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.476 -1.39 . . . . 0.0 112.034 -176.703 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 157.02 -68.18 0.29 Allowed Glycine 0 N--CA 1.496 2.661 0 O-C-N 120.528 -1.357 . . . . 0.0 114.258 175.52 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -80.91 169.06 18.02 Favored 'General case' 0 CA--C 1.577 1.99 0 CA-C-O 121.858 0.837 . . . . 0.0 111.525 166.937 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.47 106.17 1.3 Allowed 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 106.382 -1.71 . . . . 0.0 106.382 -179.583 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.3 m -93.83 83.48 4.4 Favored 'General case' 0 CA--C 1.56 1.333 0 CA-C-O 122.446 1.117 . . . . 0.0 113.679 -173.541 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.9 mp -87.22 61.96 7.0 Favored 'General case' 0 CA--C 1.58 2.115 0 CA-C-O 122.041 0.924 . . . . 0.0 111.607 175.747 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 55.5 t -136.53 93.66 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 -176.264 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.96 66.24 3.62 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 115.998 1.159 . . . . 0.0 115.998 175.958 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 36.0 t -128.3 -123.93 0.23 Allowed 'General case' 0 CA--C 1.574 1.88 0 C-N-CA 123.736 0.814 . . . . 0.0 110.333 179.449 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.4 pt -87.68 -64.8 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.143 0 O-C-N 120.3 -1.5 . . . . 0.0 112.26 179.568 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 29.8 p -114.12 -178.66 3.43 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 119.655 1.116 . . . . 0.0 110.665 174.461 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 37.6 t30 64.64 67.53 0.55 Allowed 'General case' 0 N--CA 1.503 2.213 0 O-C-N 120.857 -1.152 . . . . 0.0 107.999 -172.737 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 36.4 p -98.64 -57.37 2.2 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 -169.925 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -157.63 81.88 0.89 Allowed 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 175.726 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.9 m-30 -112.53 161.33 16.88 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 -173.792 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -160.55 167.31 35.69 Favored Glycine 0 CA--C 1.556 2.61 0 C-N-CA 124.895 1.236 . . . . 0.0 112.866 -179.573 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.5 mm -98.35 134.14 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.519 0 O-C-N 119.582 -2.128 . . . . 0.0 110.436 -179.388 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 94.9 m -63.21 123.83 19.64 Favored 'General case' 0 CA--C 1.572 1.792 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 174.662 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 79.0 m-70 -144.33 155.48 43.83 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-O 122.553 1.168 . . . . 0.0 111.613 175.57 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 40.0 t-20 -96.71 122.92 40.18 Favored 'General case' 0 CA--C 1.566 1.594 0 O-C-N 120.892 -1.13 . . . . 0.0 110.354 179.433 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.5 t -134.74 86.45 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 -174.964 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 84.15 -61.17 4.76 Favored Glycine 0 N--CA 1.496 2.662 0 N-CA-C 117.272 1.669 . . . . 0.0 117.272 -178.653 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? 72.98 92.68 0.08 Allowed 'General case' 0 N--CA 1.497 1.894 0 C-N-CA 125.332 1.453 . . . . 0.0 112.413 179.08 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 83.2 p . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 124.265 1.983 . . . . 0.0 112.873 177.55 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 23.3 m . . . . . 0 CA--C 1.579 2.085 0 CA-C-O 118.967 -0.539 . . . . 0.0 112.15 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -64.9 -28.22 58.59 Favored 'Trans proline' 0 CA--C 1.573 2.449 0 N-CA-C 117.547 2.095 . . . . 0.0 117.547 175.837 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -110.79 82.6 3.07 Favored Pre-proline 0 CA--C 1.581 2.145 0 C-N-CA 124.272 1.029 . . . . 0.0 110.624 174.643 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.85 92.43 1.04 Allowed 'Trans proline' 0 CA--C 1.569 2.239 0 C-N-CA 122.644 2.229 . . . . 0.0 114.341 -177.491 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.469 ' H ' ' HD3' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -83.5 56.7 3.7 Favored 'General case' 0 CA--C 1.577 2.018 0 N-CA-C 114.776 1.398 . . . . 0.0 114.776 -178.494 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.35 78.77 0.08 OUTLIER Glycine 0 N--CA 1.489 2.196 0 O-C-N 120.901 -1.124 . . . . 0.0 113.737 -178.952 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 11.0 tp -71.48 -31.69 43.74 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.011 0 N-CA-C 117.541 2.422 . . . . 0.0 117.541 -174.041 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.255 41.0 mt 75.87 -49.85 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.658 0 CA-C-N 120.307 1.412 . . . . 0.0 113.542 177.599 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.431 HG13 ' H ' ' A' ' 10' ' ' ASN . 16.7 pt -96.93 -94.01 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 CA-C-N 120.346 1.43 . . . . 0.0 111.351 -174.191 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.431 ' H ' HG13 ' A' ' 9' ' ' ILE 0.307 0.0 OUTLIER 49.35 75.07 0.16 Allowed 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 116.656 2.095 . . . . 0.0 116.656 -179.993 . . . . . . . . 4 4 . 1 . 022 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 tp -132.34 120.49 22.14 Favored 'General case' 0 CA--C 1.569 1.707 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 -174.853 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -81.78 173.55 12.18 Favored 'General case' 0 CA--C 1.569 1.693 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 -172.659 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -56.37 137.87 51.94 Favored 'General case' 0 CA--C 1.568 1.652 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 176.787 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.8 -17.49 27.6 Favored Glycine 0 N--CA 1.497 2.734 0 N-CA-C 118.122 2.009 . . . . 0.0 118.122 -177.162 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -100.3 145.56 27.99 Favored 'General case' 0 CA--C 1.564 1.503 0 CA-C-N 118.428 1.114 . . . . 0.0 112.216 -177.251 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 72.6 mt -77.9 137.55 38.42 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 122.08 0.943 . . . . 0.0 113.119 -179.634 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.6 p -138.62 149.65 45.44 Favored 'General case' 0 CA--C 1.562 1.417 0 CA-C-O 122.073 0.939 . . . . 0.0 112.827 -174.567 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 98.7 mt -84.38 -74.04 0.4 Allowed 'General case' 0 CA--C 1.567 1.616 0 O-C-N 121.424 -0.797 . . . . 0.0 109.126 174.434 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.8 p30 -95.06 173.58 7.51 Favored 'General case' 0 CA--C 1.577 1.984 0 CA-C-N 120.111 1.323 . . . . 0.0 113.473 172.846 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.8 m -78.69 -19.27 52.86 Favored 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 116.994 2.22 . . . . 0.0 116.994 174.923 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.72 31.62 0.16 Allowed 'General case' 0 CA--C 1.579 2.083 0 N-CA-C 116.685 2.105 . . . . 0.0 116.685 174.342 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -114.72 -34.77 5.05 Favored 'General case' 0 CA--C 1.576 1.977 0 C-N-CA 126.414 1.886 . . . . 0.0 113.003 174.393 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . 0.273 67.3 m -80.67 -133.82 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.909 0 CA-C-N 120.87 1.668 . . . . 0.0 114.533 -174.983 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.3 -77.43 0.19 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 119.238 -2.164 . . . . 0.0 112.378 -173.777 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 77.4 p -88.33 -63.86 1.23 Allowed 'General case' 0 CA--C 1.568 1.653 0 CA-C-O 122.547 1.165 . . . . 0.0 110.481 173.09 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -169.66 81.78 0.12 Allowed 'General case' 0 CA--C 1.568 1.665 0 N-CA-C 103.991 -2.596 . . . . 0.0 103.991 177.416 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 53.5 t -140.85 62.98 1.47 Allowed 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 118.634 2.827 . . . . 0.0 118.634 -171.71 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 22.7 t -93.39 116.68 29.23 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 170.796 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.31 118.42 36.85 Favored 'General case' 0 CA--C 1.57 1.718 0 CA-C-O 122.663 1.221 . . . . 0.0 113.716 -172.367 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.517 ' HB2' HG12 ' A' ' 57' ' ' VAL . 5.6 t-160 -84.13 125.09 31.83 Favored 'General case' 0 CA--C 1.564 1.491 0 C-N-CA 124.921 1.289 . . . . 0.0 111.184 -178.025 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . 0.3 0.3 OUTLIER -83.41 57.64 4.12 Favored 'General case' 0 CA--C 1.58 2.117 0 O-C-N 120.735 -1.228 . . . . 0.0 114.252 175.191 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.351 18.3 p 90.83 178.77 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.756 0 C-N-CA 127.13 2.172 . . . . 0.0 112.354 -174.897 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 14.8 mm -59.86 -62.45 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 119.616 -1.928 . . . . 0.0 115.282 -172.695 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.5 tp -92.62 79.93 4.82 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-N 120.184 1.356 . . . . 0.0 108.863 174.951 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.3 p -145.96 172.23 13.67 Favored 'General case' 0 CA--C 1.568 1.67 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 -173.194 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 39.9 tp -88.16 140.08 29.85 Favored 'General case' 0 CA--C 1.574 1.865 0 CA-C-O 121.682 0.753 . . . . 0.0 111.507 174.514 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.5 m -104.61 110.92 23.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.951 -1.093 . . . . 0.0 112.063 -175.024 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.5 ttp180 -121.12 142.02 50.26 Favored 'General case' 0 CA--C 1.567 1.629 0 C-N-CA 124.21 1.004 . . . . 0.0 109.758 178.615 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 55.2 m -69.81 150.78 46.49 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-O 124.776 2.227 . . . . 0.0 114.323 179.03 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -132.39 -178.39 4.9 Favored 'General case' 0 CA--C 1.562 1.442 0 CA-C-N 111.774 -2.466 . . . . 0.0 113.111 -174.18 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.1 mt -84.89 138.19 32.68 Favored 'General case' 0 CA--C 1.567 1.597 0 O-C-N 121.242 -0.911 . . . . 0.0 111.742 177.75 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -68.4 139.64 55.8 Favored 'General case' 0 CA--C 1.576 1.945 0 O-C-N 121.56 -0.712 . . . . 0.0 111.065 173.841 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.39 151.31 39.72 Favored 'General case' 0 CA--C 1.57 1.712 0 N-CA-C 118.122 2.638 . . . . 0.0 118.122 -171.359 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 50.5 mtp180 -104.1 168.95 8.78 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 112.809 -1.996 . . . . 0.0 111.866 -178.903 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -52.77 126.68 20.81 Favored 'General case' 0 CA--C 1.573 1.837 0 N-CA-C 114.222 1.194 . . . . 0.0 114.222 -174.915 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 71.66 32.65 1.95 Allowed 'General case' 0 N--CA 1.503 2.214 0 C-N-CA 125.132 1.373 . . . . 0.0 113.599 -172.951 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.7 m -130.24 153.49 48.55 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.685 -1.26 . . . . 0.0 111.033 174.83 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -69.98 136.1 50.1 Favored 'General case' 0 CA--C 1.574 1.882 0 CA-C-O 124.002 1.858 . . . . 0.0 114.412 -176.177 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.434 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 26.7 p -138.93 148.25 43.32 Favored 'General case' 0 CA--C 1.566 1.593 0 CA-C-N 112.563 -2.108 . . . . 0.0 111.496 -178.372 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.3 m -78.25 107.76 11.09 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.277 -1.514 . . . . 0.0 108.253 174.299 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.34 -40.14 62.36 Favored 'General case' 0 CA--C 1.57 1.718 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -174.618 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -86.36 145.65 26.8 Favored 'General case' 0 CA--C 1.571 1.781 0 C-N-CA 124.344 1.058 . . . . 0.0 109.202 172.278 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.7 p -123.93 145.7 48.96 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-O 123.796 1.76 . . . . 0.0 109.867 173.406 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.264 0.6 OUTLIER -109.1 -135.25 0.35 Allowed 'General case' 0 CA--C 1.565 1.55 0 CA-C-N 113.404 -1.725 . . . . 0.0 106.668 174.551 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -130.95 71.34 1.47 Allowed 'General case' 0 CA--C 1.569 1.69 0 N-CA-C 104.023 -2.584 . . . . 0.0 104.023 170.178 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 169.74 -159.72 32.52 Favored Glycine 0 N--CA 1.486 1.968 0 N-CA-C 117.125 1.61 . . . . 0.0 117.125 -174.177 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.517 HG12 ' HB2' ' A' ' 30' ' ' HIS . 5.2 t -79.19 146.92 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.99 0 CA-C-O 122.343 1.068 . . . . 0.0 112.277 -166.801 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -123.87 158.41 31.95 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -173.153 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -86.16 -21.91 27.3 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 174.373 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -146.37 122.8 11.01 Favored 'General case' 0 CA--C 1.564 1.519 0 N-CA-C 105.507 -2.035 . . . . 0.0 105.507 177.826 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.473 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 56.9 m -58.91 134.05 87.07 Favored Pre-proline 0 CA--C 1.597 2.775 0 O-C-N 119.888 -1.758 . . . . 0.0 115.27 -179.907 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 61' ' ' CYS . 36.5 Cg_exo -66.76 64.77 0.56 Allowed 'Trans proline' 0 CA--C 1.581 2.825 0 N-CA-C 121.307 3.541 . . . . 0.0 121.307 -174.064 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 69.1 m 58.53 164.0 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 175.838 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -79.21 166.27 22.36 Favored 'General case' 0 CA--C 1.576 1.977 0 O-C-N 120.64 -1.287 . . . . 0.0 113.934 174.287 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -63.43 115.29 4.49 Favored 'General case' 0 CA--C 1.573 1.864 0 O-C-N 120.965 -1.085 . . . . 0.0 113.612 -178.05 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 107.31 -17.99 36.46 Favored Glycine 0 N--CA 1.5 2.931 0 N-CA-C 118.311 2.084 . . . . 0.0 118.311 -174.193 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.1 mp -98.04 151.81 19.94 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-N 118.584 1.192 . . . . 0.0 111.638 179.049 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -100.26 149.87 23.14 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.835 -1.166 . . . . 0.0 112.192 175.982 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 11.8 t -92.6 120.03 32.64 Favored 'General case' 0 CA--C 1.567 1.634 0 CA-C-N 115.07 -0.968 . . . . 0.0 108.892 172.924 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -95.0 80.5 3.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.748 -1.22 . . . . 0.0 110.991 -174.031 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -82.86 69.42 3.37 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 118.636 2.214 . . . . 0.0 118.636 -174.211 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -75.92 -44.3 40.93 Favored 'General case' 0 CA--C 1.574 1.9 0 N-CA-C 115.037 1.495 . . . . 0.0 115.037 176.897 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -137.05 111.74 8.75 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 120.04 1.291 . . . . 0.0 109.212 175.861 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.7 t -155.25 -62.23 0.12 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.398 -0.814 . . . . 0.0 111.709 174.715 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 56.19 82.73 0.1 Allowed 'General case' 0 CA--C 1.579 2.082 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 174.184 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . 0.366 2.3 p 57.87 -52.11 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.286 0 N-CA-C 120.266 3.432 . . . . 0.0 120.266 174.582 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.82 29.9 66.7 Favored Glycine 0 N--CA 1.495 2.605 0 N-CA-C 119.523 2.569 . . . . 0.0 119.523 -177.256 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.2 t -69.93 -39.8 75.9 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 116.253 1.945 . . . . 0.0 116.253 -179.883 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 10.4 tp -119.42 68.5 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.212 0 CA-C-O 123.516 1.627 . . . . 0.0 108.095 172.655 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.253 9.7 t 37.09 118.95 0.0 OUTLIER 'General case' 0 CA--C 1.578 2.037 0 N-CA-C 118.408 2.744 . . . . 0.0 118.408 -173.646 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 57.0 t-20 -150.15 89.01 1.55 Allowed 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 103.73 -2.693 . . . . 0.0 103.73 173.838 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 67.1 p -99.17 71.82 1.84 Allowed 'General case' 0 N--CA 1.496 1.862 0 CA-C-O 124.77 2.224 . . . . 0.0 113.93 -172.126 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -144.78 121.26 11.02 Favored 'General case' 0 CA--C 1.563 1.469 0 CA-C-N 110.645 -2.98 . . . . 0.0 104.808 173.664 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -128.08 161.12 29.97 Favored 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 122.426 1.107 . . . . 0.0 112.212 -173.587 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.39 157.57 51.64 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 115.717 1.047 . . . . 0.0 115.717 177.314 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 33.3 mm -104.52 140.41 22.66 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 121.22 -1.165 . . . . 0.0 110.925 -172.224 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.434 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 89.6 m -72.22 122.92 21.87 Favored 'General case' 0 CA--C 1.566 1.561 0 O-C-N 120.567 -1.333 . . . . 0.0 113.465 174.637 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -133.55 151.36 51.72 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.825 -1.172 . . . . 0.0 110.393 176.296 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -94.36 127.3 40.16 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 122.517 1.151 . . . . 0.0 111.271 -174.374 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 9.2 p -144.12 -16.97 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 -173.97 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 89.06 -54.4 3.98 Favored Glycine 0 N--CA 1.496 2.668 0 CA-C-N 120.64 1.564 . . . . 0.0 116.606 -178.641 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -70.32 -6.93 38.65 Favored 'General case' 0 CA--C 1.585 2.31 0 N-CA-C 117.477 2.399 . . . . 0.0 117.477 177.537 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 32.9 t . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 123.779 1.752 . . . . 0.0 111.618 175.493 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 40.0 t . . . . . 0 CA--C 1.579 2.064 0 CA-C-O 117.993 -1.003 . . . . 0.0 108.56 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -77.38 82.23 2.44 Favored 'Trans proline' 0 CA--C 1.57 2.308 0 C-N-CA 122.628 2.219 . . . . 0.0 113.97 -179.315 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 82.62 86.55 0.05 OUTLIER Pre-proline 0 CA--C 1.581 2.148 0 C-N-CA 126.776 2.03 . . . . 0.0 109.515 -174.305 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -66.3 -38.46 20.55 Favored 'Trans proline' 0 CA--C 1.565 2.069 0 N-CA-C 118.097 2.307 . . . . 0.0 118.097 -174.793 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 64.3 ttt-85 -85.33 70.02 10.78 Favored 'General case' 0 CA--C 1.577 2.001 0 CA-C-N 120.025 1.284 . . . . 0.0 110.888 174.241 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 25.31 75.11 0.01 OUTLIER Glycine 0 N--CA 1.5 2.902 0 N-CA-C 121.012 3.165 . . . . 0.0 121.012 179.716 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . 0.334 4.5 tp 46.95 28.73 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.593 2.598 0 N-CA-C 118.73 2.863 . . . . 0.0 118.73 -176.548 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.308 3.3 mp 60.13 52.87 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.592 2.575 0 C-N-CA 125.428 1.491 . . . . 0.0 112.398 177.926 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 5.6 pt -127.69 -108.78 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 120.081 -1.637 . . . . 0.0 107.762 176.865 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 57.54 68.84 0.8 Allowed 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 117.495 2.406 . . . . 0.0 117.495 172.88 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . 0.25 28.3 tp -110.13 133.78 52.87 Favored 'General case' 0 CA--C 1.581 2.136 0 O-C-N 120.665 -1.272 . . . . 0.0 109.392 174.42 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -77.18 160.5 28.91 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 119.509 -1.995 . . . . 0.0 115.369 -173.934 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.38 128.25 34.98 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 122.215 1.007 . . . . 0.0 109.855 173.409 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 96.89 24.37 13.32 Favored Glycine 0 CA--C 1.557 2.663 0 N-CA-C 116.423 1.329 . . . . 0.0 116.423 -172.967 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -129.27 139.25 51.87 Favored 'General case' 0 CA--C 1.567 1.63 0 CA-C-N 118.533 1.167 . . . . 0.0 109.427 177.638 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.8 mp -65.7 128.74 37.18 Favored 'General case' 0 CA--C 1.574 1.891 0 O-C-N 120.919 -1.113 . . . . 0.0 112.746 -178.063 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.0 p -129.16 154.09 47.08 Favored 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 -174.313 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.4 mt -85.46 -76.82 0.31 Allowed 'General case' 0 CA--C 1.568 1.64 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 173.919 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.8 p30 -97.35 172.92 7.47 Favored 'General case' 0 CA--C 1.577 2.002 0 CA-C-N 120.003 1.274 . . . . 0.0 113.747 172.915 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.6 m -77.75 -20.63 53.1 Favored 'General case' 0 N--CA 1.505 2.28 0 N-CA-C 116.956 2.206 . . . . 0.0 116.956 175.001 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.58 10.74 1.56 Allowed 'General case' 0 CA--C 1.575 1.928 0 N-CA-C 117.292 2.33 . . . . 0.0 117.292 174.951 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -97.17 -29.28 13.68 Favored 'General case' 0 CA--C 1.576 1.964 0 C-N-CA 125.152 1.381 . . . . 0.0 114.224 173.972 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 5.3 m -80.78 159.31 25.19 Favored 'General case' 0 CA--C 1.574 1.87 0 N-CA-C 115.081 1.511 . . . . 0.0 115.081 -179.521 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.7 mptt -63.51 -57.31 10.59 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 120.843 -1.161 . . . . 0.0 108.906 170.717 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.8 t -82.02 104.19 12.2 Favored 'General case' 0 CA--C 1.565 1.548 0 N-CA-C 104.537 -2.394 . . . . 0.0 104.537 170.166 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -68.59 82.31 0.27 Allowed 'General case' 0 N--CA 1.5 2.056 0 CA-C-O 124.411 2.053 . . . . 0.0 113.445 -172.89 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 49.7 t -160.7 87.17 0.74 Allowed 'General case' 0 CA--C 1.558 1.272 0 CA-C-N 112.499 -2.137 . . . . 0.0 111.421 -177.284 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 37.1 t -79.16 110.7 14.67 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 102.911 -2.996 . . . . 0.0 102.911 170.557 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.69 112.82 24.9 Favored 'General case' 0 CA--C 1.557 1.218 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -170.384 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.545 ' HB2' HG12 ' A' ' 57' ' ' VAL . 15.6 t-80 -81.02 141.18 34.65 Favored 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 124.822 1.249 . . . . 0.0 113.126 -175.702 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.2 p-10 -69.45 17.32 0.05 OUTLIER 'General case' 0 CA--C 1.591 2.558 0 N-CA-C 117.753 2.501 . . . . 0.0 117.753 172.412 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.275 43.0 p 74.75 97.59 0.07 Allowed 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 127.216 2.206 . . . . 0.0 112.402 176.683 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.276 37.3 mm 75.12 -49.98 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.387 0 C-N-CA 125.464 1.506 . . . . 0.0 115.014 174.775 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.258 0.5 OUTLIER -76.9 -121.82 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.143 0 CA-C-N 122.551 2.432 . . . . 0.0 112.965 -179.223 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 82.9 p -159.72 102.09 1.5 Allowed 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 123.943 3.065 . . . . 0.0 117.167 179.964 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 tt -164.39 105.76 0.87 Allowed 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 102.802 -3.036 . . . . 0.0 102.802 173.307 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.6 m -121.13 122.7 40.58 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.865 0.84 . . . . 0.0 112.313 -173.666 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -138.22 136.38 36.52 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 123.94 0.896 . . . . 0.0 110.627 -174.312 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 67.1 m -61.5 146.26 49.18 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 119.906 -1.746 . . . . 0.0 114.839 -177.48 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -142.74 169.58 17.3 Favored 'General case' 0 CA--C 1.567 1.601 0 CA-C-O 123.663 1.697 . . . . 0.0 115.028 -174.514 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.43 ' H ' HD23 ' A' ' 41' ' ' LEU . 2.5 pt? -91.07 167.9 12.03 Favored 'General case' 0 CA--C 1.573 1.835 0 CA-C-N 114.329 -1.305 . . . . 0.0 111.459 173.89 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.9 158.5 25.08 Favored 'General case' 0 CA--C 1.584 2.27 0 O-C-N 120.344 -1.472 . . . . 0.0 113.467 174.492 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.49 166.94 22.68 Favored 'General case' 0 CA--C 1.572 1.822 0 O-C-N 120.236 -1.54 . . . . 0.0 113.161 177.868 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -96.54 163.11 13.17 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.553 -1.342 . . . . 0.0 112.895 -174.408 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -63.89 129.08 38.62 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.337 0.589 . . . . 0.0 111.083 177.364 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 79.81 14.95 0.9 Allowed 'General case' 0 N--CA 1.509 2.477 0 C-N-CA 125.069 1.348 . . . . 0.0 113.758 -171.991 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 27.2 t -113.88 160.14 19.09 Favored 'General case' 0 CA--C 1.566 1.578 0 O-C-N 120.385 -1.447 . . . . 0.0 111.887 174.73 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 65.8 mt-10 -70.85 116.81 11.58 Favored 'General case' 0 CA--C 1.571 1.771 0 CA-C-O 122.925 1.345 . . . . 0.0 113.729 -175.69 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.446 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 15.5 p -124.04 160.5 27.55 Favored 'General case' 0 CA--C 1.568 1.644 0 CA-C-N 113.987 -1.461 . . . . 0.0 113.812 177.766 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.6 t -134.22 123.81 24.92 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 105.363 -2.088 . . . . 0.0 105.363 171.775 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.96 62.82 3.49 Favored 'General case' 0 CA--C 1.565 1.557 0 N-CA-C 115.915 1.821 . . . . 0.0 115.915 -173.96 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.13 141.62 25.38 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 118.742 2.867 . . . . 0.0 118.742 -172.485 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 64.8 p -141.74 147.87 38.09 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 123.396 1.57 . . . . 0.0 108.834 172.201 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -134.59 -124.25 0.16 Allowed 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 174.598 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -132.61 57.97 1.78 Allowed 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 173.476 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -169.93 -172.48 36.49 Favored Glycine 0 N--CA 1.487 2.037 0 N-CA-C 115.584 0.994 . . . . 0.0 115.584 -173.396 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.545 HG12 ' HB2' ' A' ' 30' ' ' HIS . 3.3 t -81.45 143.42 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 CA-C-O 122.233 1.016 . . . . 0.0 111.808 -172.569 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -119.33 139.89 51.22 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-O 121.909 0.862 . . . . 0.0 112.6 -173.36 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -74.64 -6.39 48.39 Favored 'General case' 0 CA--C 1.589 2.478 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 174.181 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.62 127.36 3.17 Favored 'General case' 0 CA--C 1.568 1.64 0 C-N-CA 127.302 2.241 . . . . 0.0 106.454 -174.292 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.0 m -68.29 133.57 91.33 Favored Pre-proline 0 CA--C 1.587 2.374 0 O-C-N 119.705 -1.872 . . . . 0.0 112.537 174.124 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -52.31 -0.72 0.06 OUTLIER 'Trans proline' 0 CA--C 1.57 2.279 1 N-CA-C 123.877 4.53 . . . . 0.0 123.877 -174.761 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 73.37 -40.34 0.46 Allowed 'General case' 0 N--CA 1.503 2.186 0 N-CA-C 119.019 2.97 . . . . 0.0 119.019 174.205 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.269 15.2 pt-20 -89.2 59.53 4.95 Favored 'General case' 0 CA--C 1.555 1.151 1 N-CA-C 125.568 5.396 . . . . 0.0 125.568 -172.118 . . . . . . . . 3 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.2 mtm105 -88.68 87.81 7.39 Favored 'General case' 0 N--CA 1.501 2.103 0 N-CA-C 104.959 -2.237 . . . . 0.0 104.959 168.001 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 78.8 25.25 60.65 Favored Glycine 0 CA--C 1.568 3.376 0 N-CA-C 116.705 1.442 . . . . 0.0 116.705 -170.943 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . 0.272 4.9 tt -142.13 -162.37 1.39 Allowed 'General case' 0 CA--C 1.581 2.143 0 C-N-CA 125.346 1.458 . . . . 0.0 109.576 -176.283 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -140.06 138.57 35.48 Favored 'General case' 0 CA--C 1.578 2.052 0 O-C-N 118.688 -2.507 . . . . 0.0 110.744 174.229 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 43.4 t -93.05 123.63 36.44 Favored 'General case' 0 CA--C 1.568 1.64 0 O-C-N 121.261 -0.899 . . . . 0.0 108.602 170.832 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -94.51 74.82 3.81 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.138 -1.601 . . . . 0.0 110.378 179.433 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -105.78 72.31 0.22 Allowed Glycine 0 N--CA 1.489 2.209 0 N-CA-C 115.39 0.916 . . . . 0.0 115.39 -176.158 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -71.8 -46.21 59.0 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 178.661 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -156.23 -80.62 0.08 Allowed 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 106.06 -1.83 . . . . 0.0 106.06 174.322 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 76.5 p -141.78 69.74 1.33 Allowed 'General case' 0 CA--C 1.567 1.598 0 O-C-N 121.482 -0.761 . . . . 0.0 112.794 175.14 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -89.66 77.46 7.14 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 172.355 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.8 p -96.34 -45.72 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 N-CA-C 118.156 2.65 . . . . 0.0 118.156 -170.396 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 83.55 -77.41 2.12 Favored Glycine 0 N--CA 1.494 2.509 0 O-C-N 120.998 -1.064 . . . . 0.0 113.418 -174.383 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.3 t -91.96 101.14 13.7 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 170.223 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.0 pp -52.89 143.15 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.779 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 -173.748 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 40.1 p -128.69 171.46 12.17 Favored 'General case' 0 N--CA 1.495 1.802 0 CA-C-N 112.337 -2.211 . . . . 0.0 111.576 -176.544 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -63.57 -16.31 60.49 Favored 'General case' 0 CA--C 1.582 2.203 0 N-CA-C 118.133 2.642 . . . . 0.0 118.133 177.436 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . 0.303 2.1 t -130.8 -110.28 0.26 Allowed 'General case' 0 CA--C 1.57 1.731 0 CA-C-N 121.243 1.838 . . . . 0.0 110.087 -175.162 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -160.2 106.16 1.55 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.293 -1.504 . . . . 0.0 111.757 -173.622 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -127.59 156.96 41.44 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.986 -1.072 . . . . 0.0 113.837 -176.238 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -106.17 -165.04 22.99 Favored Glycine 0 N--CA 1.492 2.426 0 C-N-CA 123.572 0.605 . . . . 0.0 113.941 173.547 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 34.0 mm -121.56 142.79 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.251 0 CA-C-O 122.472 1.129 . . . . 0.0 110.429 178.94 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.446 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 82.8 m -67.91 118.09 10.66 Favored 'General case' 0 CA--C 1.57 1.714 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 174.033 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -142.64 139.62 31.32 Favored 'General case' 0 N--CA 1.483 1.175 0 O-C-N 120.548 -1.345 . . . . 0.0 107.879 173.853 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -94.41 70.6 3.7 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 123.949 1.833 . . . . 0.0 112.027 -175.9 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.5 m -109.59 -42.32 5.21 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.691 0 CA-C-N 112.667 -2.061 . . . . 0.0 113.947 -175.265 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -80.45 -18.58 70.81 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 119.263 2.465 . . . . 0.0 119.263 174.849 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -86.15 80.0 8.93 Favored 'General case' 0 CA--C 1.572 1.816 0 CA-C-N 119.839 1.82 . . . . 0.0 111.73 179.1 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 42.4 m . . . . . 0 N--CA 1.504 2.25 0 N-CA-C 115.843 1.794 . . . . 0.0 115.843 -178.881 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.257 9.2 p . . . . . 0 CA--C 1.586 2.353 0 CA-C-O 114.797 -2.525 . . . . 0.0 116.311 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -76.24 96.75 1.08 Allowed 'Trans proline' 0 CA--C 1.571 2.329 0 CA-C-N 127.647 3.767 . . . . 0.0 113.016 178.464 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -104.47 93.99 6.53 Favored Pre-proline 0 CA--C 1.581 2.135 0 CA-C-O 117.746 -1.121 . . . . 0.0 112.183 -174.762 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -74.83 104.96 1.98 Allowed 'Trans proline' 0 CA--C 1.568 2.215 0 C-N-CA 122.642 2.228 . . . . 0.0 113.366 177.032 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.7 tpm_? -70.08 -29.01 65.9 Favored 'General case' 0 CA--C 1.578 2.023 0 N-CA-C 117.234 2.309 . . . . 0.0 117.234 -175.66 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -79.68 72.48 2.55 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 117.507 1.763 . . . . 0.0 117.507 -179.564 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 49.8 mm -98.38 -66.84 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 C-N-CA 123.995 0.918 . . . . 0.0 109.332 -179.229 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.9 mm -106.1 -59.12 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.261 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 173.962 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 31.7 pt -102.63 177.3 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.575 1.916 0 CA-C-N 119.531 1.059 . . . . 0.0 110.122 173.071 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 63.53 57.72 1.43 Allowed 'General case' 0 CA--C 1.582 2.18 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 pp -128.44 169.22 14.56 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 116.022 1.86 . . . . 0.0 116.022 -174.759 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -75.0 169.77 17.34 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 115.702 1.741 . . . . 0.0 115.702 -173.026 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -75.08 153.36 38.39 Favored 'General case' 0 CA--C 1.575 1.931 0 CA-C-O 122.253 1.025 . . . . 0.0 112.452 176.921 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 92.43 23.29 26.95 Favored Glycine 0 N--CA 1.496 2.643 0 N-CA-C 116.706 1.442 . . . . 0.0 116.706 -173.066 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 -135.62 142.87 45.29 Favored 'General case' 0 CA--C 1.569 1.676 0 C-N-CA 124.773 1.229 . . . . 0.0 110.805 -177.917 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.4 tp -77.9 142.21 38.57 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -174.844 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.9 p -131.88 -178.58 4.95 Favored 'General case' 0 CA--C 1.575 1.936 0 CA-C-O 123.106 1.431 . . . . 0.0 114.601 -176.201 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.9 mt -107.79 -74.59 0.65 Allowed 'General case' 0 CA--C 1.574 1.902 0 N-CA-C 104.851 -2.277 . . . . 0.0 104.851 170.603 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -95.86 -168.59 1.79 Allowed 'General case' 0 CA--C 1.587 2.384 0 CA-C-N 119.986 1.266 . . . . 0.0 113.345 171.758 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.0 m -90.15 -9.47 48.15 Favored 'General case' 0 N--CA 1.507 2.425 0 N-CA-C 117.034 2.235 . . . . 0.0 117.034 174.291 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.73 10.35 2.26 Favored 'General case' 0 CA--C 1.577 2.005 0 N-CA-C 117.395 2.368 . . . . 0.0 117.395 175.24 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -94.2 -29.88 14.88 Favored 'General case' 0 CA--C 1.569 1.693 0 C-N-CA 124.807 1.243 . . . . 0.0 113.821 176.866 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . 0.259 80.4 m -81.99 -172.72 4.09 Favored 'General case' 0 CA--C 1.585 2.314 0 CA-C-N 121.866 2.121 . . . . 0.0 111.382 173.035 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -56.11 -69.87 0.13 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 119.345 -2.097 . . . . 0.0 116.646 -172.014 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.0 t -86.86 -72.51 0.5 Allowed 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 122.053 0.93 . . . . 0.0 111.443 174.315 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -172.17 63.96 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.937 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.63 -174.017 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 37.5 t -139.74 71.84 1.39 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 119.368 -2.082 . . . . 0.0 116.378 -173.731 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.3 t -98.03 123.86 42.25 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 170.637 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -103.23 120.3 40.48 Favored 'General case' 0 CA--C 1.573 1.835 0 CA-C-O 122.956 1.36 . . . . 0.0 114.053 -172.456 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.522 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.1 t60 -86.07 133.37 33.9 Favored 'General case' 0 CA--C 1.562 1.422 0 C-N-CA 125.322 1.449 . . . . 0.0 112.389 -177.482 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -82.69 59.04 4.53 Favored 'General case' 0 CA--C 1.58 2.119 0 O-C-N 120.63 -1.294 . . . . 0.0 114.39 173.935 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.256 6.0 t 48.38 88.55 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.316 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 175.857 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.3 4.2 mp 73.92 -57.57 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.633 0 C-N-CA 125.419 1.488 . . . . 0.0 111.325 -178.734 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.0 mt -62.29 114.28 3.38 Favored 'General case' 0 N--CA 1.496 1.873 0 CA-C-N 120.833 1.651 . . . . 0.0 109.572 173.809 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.0 p -85.46 50.04 1.88 Allowed 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 120.257 3.429 . . . . 0.0 120.257 -171.135 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.3 tt -92.37 85.92 5.53 Favored 'General case' 0 N--CA 1.498 1.955 0 N-CA-C 101.799 -3.408 . . . . 0.0 101.799 169.981 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.419 ' HB3' HG11 ' A' ' 57' ' ' VAL . 51.0 m -94.75 109.59 21.53 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 122.464 1.126 . . . . 0.0 112.889 -170.545 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 29.9 ttt85 -123.94 135.5 53.71 Favored 'General case' 0 CA--C 1.562 1.414 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.267 -175.357 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 95.1 m -65.65 145.15 56.39 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 123.779 1.752 . . . . 0.0 114.103 -179.695 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -138.09 -173.08 3.42 Favored 'General case' 0 CA--C 1.566 1.564 0 CA-C-N 113.535 -1.666 . . . . 0.0 112.887 -174.177 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 pp -80.62 151.51 28.99 Favored 'General case' 0 CA--C 1.572 1.791 0 CA-C-O 122.86 1.314 . . . . 0.0 113.506 175.395 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.1 pttt -80.94 143.27 32.74 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 123.616 0.766 . . . . 0.0 110.591 173.66 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.01 152.68 38.7 Favored 'General case' 0 CA--C 1.568 1.669 0 N-CA-C 118.108 2.633 . . . . 0.0 118.108 -171.995 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -102.7 170.23 8.14 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 113.141 -1.845 . . . . 0.0 112.683 -178.533 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -50.18 130.11 22.18 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 115.176 1.547 . . . . 0.0 115.176 -174.727 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 69.32 31.63 3.82 Favored 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -173.35 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 43.4 m -129.8 153.76 47.92 Favored 'General case' 0 CA--C 1.566 1.583 0 CA-C-O 122.763 1.268 . . . . 0.0 111.345 174.98 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -74.72 115.0 13.81 Favored 'General case' 0 CA--C 1.571 1.769 0 CA-C-O 123.462 1.601 . . . . 0.0 113.537 -176.579 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 13.7 p -111.18 152.75 26.69 Favored 'General case' 0 CA--C 1.562 1.439 0 CA-C-N 113.596 -1.638 . . . . 0.0 112.229 174.57 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.9 m -77.46 108.36 10.57 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.363 -1.461 . . . . 0.0 107.546 174.292 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.94 -54.43 7.24 Favored 'General case' 0 CA--C 1.564 1.497 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -172.557 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -93.28 138.32 31.76 Favored 'General case' 0 CA--C 1.565 1.531 0 CA-C-N 118.582 0.628 . . . . 0.0 109.508 173.641 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.8 p -110.34 142.32 42.15 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 123.441 1.591 . . . . 0.0 111.901 178.138 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.72 -144.03 0.3 Allowed 'General case' 0 CA--C 1.568 1.664 0 CA-C-N 113.203 -1.817 . . . . 0.0 108.902 174.115 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -121.21 75.38 1.16 Allowed 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 103.729 -2.693 . . . . 0.0 103.729 171.474 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 174.32 -162.35 32.66 Favored Glycine 0 N--CA 1.485 1.934 0 CA-C-O 122.908 1.282 . . . . 0.0 116.295 -174.549 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.522 HG12 ' HB2' ' A' ' 30' ' ' HIS . 18.6 t -79.29 145.51 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 CA-C-O 122.841 1.305 . . . . 0.0 111.336 -176.032 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -115.35 138.78 50.61 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.016 -173.845 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -66.06 -30.83 71.42 Favored 'General case' 0 CA--C 1.587 2.386 0 O-C-N 120.034 -1.667 . . . . 0.0 115.332 -176.164 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.5 mtmm -153.82 113.49 3.83 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 102.902 -2.999 . . . . 0.0 102.902 172.794 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 67.9 m -39.85 150.23 0.26 Allowed Pre-proline 0 CA--C 1.599 2.837 0 N-CA-C 119.919 3.303 . . . . 0.0 119.919 -173.521 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -69.1 58.46 1.24 Allowed 'Trans proline' 0 CA--C 1.579 2.765 0 N-CA-C 121.674 3.682 . . . . 0.0 121.674 -173.822 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 3.4 t 61.34 162.7 0.07 Allowed 'General case' 0 CA--C 1.582 2.201 0 N-CA-C 117.823 2.527 . . . . 0.0 117.823 174.182 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -75.63 160.37 30.17 Favored 'General case' 0 CA--C 1.574 1.888 0 N-CA-C 115.494 1.665 . . . . 0.0 115.494 178.881 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -63.23 120.35 11.37 Favored 'General case' 0 CA--C 1.572 1.818 0 CA-C-O 122.553 1.168 . . . . 0.0 113.073 -179.111 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.19 -28.26 15.91 Favored Glycine 0 N--CA 1.498 2.81 0 N-CA-C 116.846 1.498 . . . . 0.0 116.846 -173.219 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.4 mp -98.65 144.9 27.42 Favored 'General case' 0 CA--C 1.565 1.539 0 CA-C-O 122.412 1.101 . . . . 0.0 111.944 -179.128 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.78 153.59 18.64 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 122.083 0.944 . . . . 0.0 112.489 -178.708 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 5.1 t -92.77 96.52 10.2 Favored 'General case' 0 CA--C 1.57 1.719 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.825 174.717 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -97.77 103.63 15.58 Favored 'General case' 0 CA--C 1.57 1.738 0 O-C-N 120.436 -1.415 . . . . 0.0 113.431 -173.966 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 154.94 -56.77 0.41 Allowed Glycine 0 N--CA 1.499 2.87 0 N-CA-C 118.994 2.358 . . . . 0.0 118.994 174.933 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 67.98 -19.5 0.14 Allowed 'General case' 0 CA--C 1.582 2.177 0 N-CA-C 118.767 2.877 . . . . 0.0 118.767 -174.961 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -142.43 122.04 13.35 Favored 'General case' 0 CA--C 1.567 1.628 0 CA-C-N 120.482 1.492 . . . . 0.0 109.651 175.271 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.8 t -92.15 86.92 5.93 Favored 'General case' 0 CA--C 1.56 1.354 0 O-C-N 120.759 -1.213 . . . . 0.0 111.413 -177.774 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 28.4 tp -57.65 -36.25 71.62 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 174.756 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 82.0 t -81.1 72.68 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.585 2.323 0 CA-C-O 122.942 1.353 . . . . 0.0 107.406 172.696 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 129.04 37.12 0.4 Allowed Glycine 0 CA--C 1.556 2.628 0 N-CA-C 116.488 1.355 . . . . 0.0 116.488 -173.45 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.9 m -95.77 74.05 3.13 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 119.519 1.66 . . . . 0.0 113.08 179.268 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.6 mp -110.13 -64.49 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 N-CA-C 105.536 -2.024 . . . . 0.0 105.536 173.689 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.4 p -84.06 -172.23 4.05 Favored 'General case' 0 CA--C 1.576 1.943 0 CA-C-O 122.863 1.316 . . . . 0.0 111.272 172.87 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -71.18 70.23 0.55 Allowed 'General case' 0 CA--C 1.575 1.935 0 O-C-N 120.291 -1.505 . . . . 0.0 112.713 174.899 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 41.0 p -97.87 71.55 2.2 Favored 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 125.999 2.809 . . . . 0.0 110.769 -174.83 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -90.72 72.84 6.7 Favored 'General case' 0 CA--C 1.566 1.569 0 CA-C-N 111.049 -2.796 . . . . 0.0 110.59 -176.099 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -125.94 149.93 48.38 Favored 'General case' 0 CA--C 1.559 1.327 0 N-CA-C 115.528 1.677 . . . . 0.0 115.528 -172.974 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -108.12 166.75 13.09 Favored Glycine 0 CA--C 1.548 2.154 0 CA-C-N 113.596 -1.638 . . . . 0.0 109.443 170.055 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 38.2 mm -102.37 135.59 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 120.23 -1.747 . . . . 0.0 109.322 179.019 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 28.6 m -62.98 119.52 9.6 Favored 'General case' 0 CA--C 1.572 1.791 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 174.235 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -139.58 153.63 47.43 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 122.452 1.12 . . . . 0.0 109.775 174.902 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -94.22 69.6 3.75 Favored 'General case' 0 N--CA 1.496 1.858 0 CA-C-O 124.02 1.867 . . . . 0.0 115.688 -172.272 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.4 t -82.37 -40.07 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 CA-C-N 112.89 -1.959 . . . . 0.0 112.572 174.752 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -72.87 -1.13 54.38 Favored Glycine 0 N--CA 1.498 2.787 0 N-CA-C 120.592 2.997 . . . . 0.0 120.592 174.85 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 35.7 ttp-105 -129.95 -71.9 0.59 Allowed 'General case' 0 CA--C 1.568 1.639 0 CA-C-N 119.483 1.642 . . . . 0.0 109.196 172.83 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 92.0 p . . . . . 0 N--CA 1.493 1.709 0 CA-C-O 124.222 1.963 . . . . 0.0 112.657 176.271 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.256 9.3 p . . . . . 0 CA--C 1.587 2.387 0 CA-C-O 114.507 -2.663 . . . . 0.0 115.898 . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -74.81 75.9 3.47 Favored 'Trans proline' 0 CA--C 1.574 2.524 0 CA-C-N 127.539 3.728 . . . . 0.0 115.453 179.722 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 60.89 69.74 1.05 Allowed Pre-proline 0 CA--C 1.589 2.448 0 C-N-CA 125.441 1.496 . . . . 0.0 113.676 -174.738 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -86.78 155.69 8.8 Favored 'Trans proline' 0 CA--C 1.567 2.157 0 C-N-CA 122.403 2.069 . . . . 0.0 115.554 -176.147 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -84.3 70.33 10.59 Favored 'General case' 0 CA--C 1.577 1.998 0 CA-C-O 122.75 1.262 . . . . 0.0 110.73 174.248 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 161.54 100.31 0.15 Allowed Glycine 0 N--CA 1.486 1.989 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.513 -174.492 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 63.7 mt -87.84 80.03 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 CA-C-O 122.533 1.159 . . . . 0.0 108.62 -175.075 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 1.8 pp -85.34 54.98 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.36 0 N-CA-C 114.841 1.422 . . . . 0.0 114.841 -174.891 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.4 pt -122.4 -146.54 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.581 2.145 0 O-C-N 120.695 -1.253 . . . . 0.0 110.407 -179.308 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 63.37 67.05 0.67 Allowed 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 178.94 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -122.11 151.18 41.2 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 123.866 1.794 . . . . 0.0 115.61 -179.214 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -83.0 166.46 18.79 Favored 'General case' 0 CA--C 1.572 1.819 0 CA-C-N 114.503 -1.226 . . . . 0.0 112.59 173.931 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.44 149.18 33.3 Favored 'General case' 0 CA--C 1.578 2.029 0 O-C-N 120.658 -1.276 . . . . 0.0 109.879 173.677 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.8 30.42 18.06 Favored Glycine 0 CA--C 1.559 2.84 0 O-C-N 121.236 -0.915 . . . . 0.0 114.979 -171.724 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -137.27 141.41 41.97 Favored 'General case' 0 CA--C 1.565 1.542 0 C-N-CA 125.024 1.33 . . . . 0.0 109.528 -174.024 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.7 tt -69.63 117.73 11.6 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.906 -1.121 . . . . 0.0 111.785 -179.054 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 39' ' ' CYS . 22.0 p -124.98 155.68 39.26 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 122.083 0.944 . . . . 0.0 113.222 -175.654 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.1 mp -91.4 -77.48 0.42 Allowed 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 173.841 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -92.38 164.9 13.32 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 115.504 1.668 . . . . 0.0 115.504 174.968 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.3 m -70.6 -22.78 62.51 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 116.474 2.028 . . . . 0.0 116.474 175.434 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.89 6.84 5.52 Favored 'General case' 0 CA--C 1.58 2.111 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 173.095 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -91.82 -41.49 10.62 Favored 'General case' 0 CA--C 1.565 1.527 0 C-N-CA 124.67 1.188 . . . . 0.0 111.899 174.148 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 74.4 m -77.41 136.77 38.43 Favored 'General case' 0 CA--C 1.571 1.787 0 CA-C-N 121.082 1.764 . . . . 0.0 110.476 174.05 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -44.58 -37.43 3.58 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 120.976 3.695 . . . . 0.0 120.976 -172.247 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.2 m -80.69 -83.26 0.11 Allowed 'General case' 0 CA--C 1.57 1.718 0 CA-C-N 118.472 0.578 . . . . 0.0 110.361 173.928 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -175.77 31.08 0.0 OUTLIER 'General case' 0 CA--C 1.588 2.431 0 C-N-CA 124.497 1.119 . . . . 0.0 113.138 -178.255 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 36.7 t -134.9 102.24 5.17 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 118.989 2.959 . . . . 0.0 118.989 -170.506 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 49.5 t -106.03 113.42 26.95 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 102.568 -3.123 . . . . 0.0 102.568 169.018 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.15 123.82 42.39 Favored 'General case' 0 CA--C 1.564 1.484 0 CA-C-O 122.059 0.933 . . . . 0.0 112.297 -173.065 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 20.4 t-80 -77.92 165.45 24.08 Favored 'General case' 0 CA--C 1.567 1.63 0 CA-C-O 122.656 1.217 . . . . 0.0 114.052 -174.742 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -80.35 -101.82 0.03 OUTLIER 'General case' 0 CA--C 1.577 2.006 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 172.631 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.1 p -150.77 90.93 1.67 Allowed 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 120.498 1.499 . . . . 0.0 108.112 174.148 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.271 5.9 mt 70.58 -31.6 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.512 2.67 0 N-CA-C 115.943 1.831 . . . . 0.0 115.943 174.603 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.4 tp -76.62 -123.31 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.151 0 CA-C-N 121.724 2.056 . . . . 0.0 111.03 174.938 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.0 p -162.05 92.82 0.86 Allowed 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 122.433 2.379 . . . . 0.0 114.986 178.11 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.0 tp -150.86 83.83 1.34 Allowed 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 104.067 -2.568 . . . . 0.0 104.067 172.746 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.8 m -104.5 131.34 51.99 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 122.646 1.213 . . . . 0.0 112.795 -173.29 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -131.71 134.82 46.32 Favored 'General case' 0 CA--C 1.562 1.419 0 C-N-CA 124.53 1.132 . . . . 0.0 108.951 -178.659 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 17' ' ' CYS . 99.4 m -65.26 146.92 54.32 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 119.874 -1.766 . . . . 0.0 113.9 178.409 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.42 179.73 6.49 Favored 'General case' 0 CA--C 1.564 1.513 0 CA-C-N 113.979 -1.464 . . . . 0.0 114.025 -173.368 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 98.1 mt -81.26 149.25 29.08 Favored 'General case' 0 CA--C 1.568 1.664 0 CA-C-O 122.097 0.951 . . . . 0.0 112.492 176.118 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -75.99 153.38 36.57 Favored 'General case' 0 CA--C 1.573 1.855 0 CA-C-O 121.856 0.836 . . . . 0.0 111.458 173.943 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.61 157.4 31.95 Favored 'General case' 0 CA--C 1.568 1.655 0 N-CA-C 116.856 2.169 . . . . 0.0 116.856 -173.252 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 43.2 mtp180 -117.58 172.03 7.62 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 113.257 -1.792 . . . . 0.0 111.308 179.45 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -48.59 132.46 17.33 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 116.216 1.932 . . . . 0.0 116.216 -172.972 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 m120 72.75 18.42 4.19 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -173.934 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.4 t -114.45 151.71 32.76 Favored 'General case' 0 CA--C 1.567 1.632 0 CA-C-O 123.11 1.433 . . . . 0.0 112.599 176.096 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -76.74 101.79 5.96 Favored 'General case' 0 CA--C 1.57 1.718 0 C-N-CA 124.86 1.264 . . . . 0.0 113.291 -177.706 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.468 ' SG ' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -99.05 156.52 16.89 Favored 'General case' 0 CA--C 1.564 1.493 0 CA-C-O 123.09 1.424 . . . . 0.0 113.793 177.254 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.1 t -82.46 96.9 8.15 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 171.522 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.6 -47.42 40.54 Favored 'General case' 0 CA--C 1.566 1.583 0 N-CA-C 115.926 1.825 . . . . 0.0 115.926 -173.304 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -89.03 153.12 21.26 Favored 'General case' 0 CA--C 1.57 1.746 0 C-N-CA 123.792 0.837 . . . . 0.0 109.547 172.904 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.1 p -126.27 146.74 49.88 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 123.946 1.831 . . . . 0.0 111.86 176.775 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -105.79 -53.0 2.72 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-N 112.869 -1.969 . . . . 0.0 113.355 175.144 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -164.76 -54.45 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.915 0 C-N-CA 127.14 2.176 . . . . 0.0 107.761 -174.875 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 112.01 94.36 2.19 Favored Glycine 0 N--CA 1.474 1.2 0 N-CA-C 116.916 1.526 . . . . 0.0 116.916 174.513 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.6 t -115.79 140.22 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 119.427 -2.219 . . . . 0.0 107.132 110.157 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -116.9 135.86 53.4 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -172.286 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -64.36 -41.48 96.71 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.616 -1.302 . . . . 0.0 113.377 174.23 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -142.2 110.59 6.05 Favored 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 103.549 -2.759 . . . . 0.0 103.549 172.503 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 57.1 m -53.02 161.5 1.22 Allowed Pre-proline 0 CA--C 1.588 2.427 0 N-CA-C 118.262 2.69 . . . . 0.0 118.262 -174.817 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.468 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 77.8 Cg_exo -53.86 172.34 0.27 Allowed 'Trans proline' 0 CA--C 1.573 2.436 0 C-N-CA 122.954 2.436 . . . . 0.0 117.984 174.917 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 63.0 m -71.5 147.33 47.86 Favored 'General case' 0 CA--C 1.569 1.703 0 O-C-N 120.849 -1.157 . . . . 0.0 113.388 174.998 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -65.46 153.12 42.27 Favored 'General case' 0 CA--C 1.572 1.825 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 179.006 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 38.7 ttp180 -40.42 -35.65 0.46 Allowed 'General case' 0 N--CA 1.507 2.411 0 N-CA-C 121.574 3.916 . . . . 0.0 121.574 -174.606 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.42 -25.06 74.98 Favored Glycine 0 CA--C 1.555 2.551 0 N-CA-C 119.985 2.754 . . . . 0.0 119.985 173.933 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -135.28 169.22 17.81 Favored 'General case' 0 CA--C 1.574 1.883 0 CA-C-N 120.21 2.005 . . . . 0.0 114.159 179.16 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -98.68 158.17 15.79 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 -173.707 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.7 t -94.86 128.3 41.51 Favored 'General case' 0 CA--C 1.57 1.723 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.046 171.451 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -93.19 98.94 11.61 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.006 -1.684 . . . . 0.0 108.152 -178.126 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.01 38.69 0.06 OUTLIER Glycine 0 N--CA 1.498 2.774 1 N-CA-C 124.728 4.651 . . . . 0.0 124.728 -172.979 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -86.35 82.74 7.88 Favored 'General case' 0 CA--C 1.571 1.755 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 164.204 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.35 49.32 0.58 Allowed 'General case' 0 CA--C 1.576 1.978 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -173.592 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.0 t 58.73 -77.07 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 126.918 2.087 . . . . 0.0 115.841 174.752 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 38.0 tp 65.01 -57.54 0.28 Allowed 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 178.269 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 97.3 t -87.13 78.98 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.573 1.854 0 CA-C-O 122.665 1.221 . . . . 0.0 109.576 -176.511 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -158.69 72.61 0.23 Allowed Glycine 0 N--CA 1.491 2.317 0 O-C-N 121.505 -0.747 . . . . 0.0 113.82 179.388 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.2 t 49.46 35.34 7.99 Favored 'General case' 0 N--CA 1.506 2.362 0 N-CA-C 118.257 2.688 . . . . 0.0 118.257 -179.638 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.345 0.2 OUTLIER 44.01 67.83 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.514 2.753 0 CA-C-O 124.449 2.071 . . . . 0.0 114.548 -174.877 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 18.2 p -117.62 163.77 15.96 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-O 124.403 2.049 . . . . 0.0 113.72 -174.476 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -70.16 -0.17 7.32 Favored 'General case' 0 CA--C 1.578 2.054 0 N-CA-C 119.064 2.986 . . . . 0.0 119.064 174.981 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 76.0 p -98.18 71.73 2.12 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 124.648 2.166 . . . . 0.0 111.411 -175.763 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -96.05 74.16 3.01 Favored 'General case' 0 CA--C 1.568 1.665 0 CA-C-N 111.764 -2.471 . . . . 0.0 110.19 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -121.34 144.95 48.37 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 116.405 2.002 . . . . 0.0 116.405 -172.216 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -107.72 151.03 16.96 Favored Glycine 0 CA--C 1.548 2.125 0 CA-C-N 114.458 -1.246 . . . . 0.0 111.19 173.453 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 24.7 mm -92.52 134.91 29.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 120.099 -1.824 . . . . 0.0 110.583 -166.464 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 98.8 m -63.98 123.59 19.39 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 175.013 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -143.73 151.63 40.27 Favored 'General case' 0 CA--C 1.563 1.449 0 CA-C-O 123.612 1.672 . . . . 0.0 110.532 174.875 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -98.08 79.72 2.63 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 124.422 2.058 . . . . 0.0 111.26 -176.071 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.9 t -105.72 74.16 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.707 0 CA-C-N 112.012 -2.358 . . . . 0.0 108.056 -175.636 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -79.91 58.51 4.54 Favored Glycine 0 N--CA 1.497 2.706 0 N-CA-C 116.727 1.451 . . . . 0.0 116.727 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 -93.71 82.67 4.34 Favored 'General case' 0 CA--C 1.569 1.692 0 CA-C-O 122.293 1.045 . . . . 0.0 111.253 -176.49 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.9 t . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 124.022 1.867 . . . . 0.0 114.303 -175.85 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 . . . . . 0 CA--C 1.579 2.093 0 N-CA-C 116.96 2.207 . . . . 0.0 116.96 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mt -132.42 152.51 51.46 Favored 'General case' 0 N--CA 1.5 2.068 0 CA-C-O 123.695 1.712 . . . . 0.0 113.269 173.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -83.81 163.51 20.1 Favored 'General case' 0 CA--C 1.571 1.752 0 CA-C-N 114.375 -1.284 . . . . 0.0 113.612 177.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.77 137.79 38.64 Favored 'General case' 0 CA--C 1.579 2.062 0 O-C-N 120.867 -1.146 . . . . 0.0 108.011 172.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.33 1.22 44.19 Favored Glycine 0 CA--C 1.56 2.889 0 N-CA-C 115.866 1.106 . . . . 0.0 115.866 -171.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -113.34 149.81 33.48 Favored 'General case' 0 CA--C 1.572 1.807 0 CA-C-N 118.951 1.375 . . . . 0.0 110.283 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.4 tt -69.45 128.12 35.42 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 120.824 -1.172 . . . . 0.0 112.87 -176.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.9 p -128.97 151.78 49.31 Favored 'General case' 0 CA--C 1.562 1.404 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -177.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.9 mt -85.84 -81.5 0.21 Allowed 'General case' 0 CA--C 1.567 1.6 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 173.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -94.53 177.76 5.82 Favored 'General case' 0 N--CA 1.499 1.981 0 CA-C-N 119.311 0.959 . . . . 0.0 112.57 173.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -71.0 -6.19 36.99 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 173.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.31 7.18 4.56 Favored 'General case' 0 CA--C 1.571 1.771 0 N-CA-C 117.128 2.27 . . . . 0.0 117.128 172.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -91.72 -51.2 5.35 Favored 'General case' 0 CA--C 1.567 1.607 0 C-N-CA 124.116 0.966 . . . . 0.0 111.97 -177.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 80.0 m -82.6 147.69 28.44 Favored 'General case' 0 CA--C 1.558 1.267 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -53.56 -53.7 47.98 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 124.039 0.936 . . . . 0.0 111.082 173.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 65.3 m -83.27 104.31 13.33 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 103.568 -2.753 . . . . 0.0 103.568 168.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.87 80.42 0.46 Allowed 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 124.998 2.332 . . . . 0.0 114.624 -172.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.0 t -142.54 72.97 1.39 Allowed 'General case' 0 CA--C 1.56 1.352 0 CA-C-N 112.291 -2.231 . . . . 0.0 110.076 -174.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 34.6 t -78.74 111.38 14.8 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 104.746 -2.316 . . . . 0.0 104.746 172.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -100.42 115.62 30.45 Favored 'General case' 0 CA--C 1.567 1.627 0 CA-C-O 122.997 1.38 . . . . 0.0 114.332 -170.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.605 ' HB2' HG12 ' A' ' 57' ' ' VAL . 15.5 t-80 -82.19 158.22 23.67 Favored 'General case' 0 CA--C 1.566 1.583 0 C-N-CA 126.047 1.739 . . . . 0.0 113.238 -178.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.3 -55.56 32.19 Favored 'General case' 0 CA--C 1.583 2.228 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 174.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.6 t 175.29 -38.88 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.518 0 C-N-CA 125.794 1.638 . . . . 0.0 111.838 -174.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 6.0 tp -157.28 -46.33 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.225 0 CA-C-N 119.95 1.25 . . . . 0.0 113.272 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.6 mt -77.07 -83.44 0.07 Allowed 'General case' 0 N--CA 1.497 1.888 0 CA-C-N 120.708 1.595 . . . . 0.0 112.91 -174.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 96.3 p -154.89 -123.65 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 121.332 1.878 . . . . 0.0 112.934 174.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.1 tt 53.96 80.72 0.11 Allowed 'General case' 0 N--CA 1.503 2.181 0 CA-C-N 120.325 1.42 . . . . 0.0 110.944 -173.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.5 m -117.06 107.65 14.78 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 122.947 1.356 . . . . 0.0 111.262 -174.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 20.7 ttp180 -125.93 141.37 52.01 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.682 1.193 . . . . 0.0 108.616 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 91.1 m -67.08 147.61 52.94 Favored 'General case' 0 CA--C 1.561 1.394 0 O-C-N 119.656 -1.903 . . . . 0.0 114.586 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.14 -177.82 5.18 Favored 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 113.262 -1.79 . . . . 0.0 112.303 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 35.5 tp -85.68 142.95 28.67 Favored 'General case' 0 CA--C 1.571 1.756 0 O-C-N 120.987 -1.071 . . . . 0.0 112.66 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -72.42 143.96 48.33 Favored 'General case' 0 CA--C 1.575 1.937 0 O-C-N 121.497 -0.752 . . . . 0.0 110.186 173.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.26 152.18 36.57 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 118.611 2.819 . . . . 0.0 118.611 -171.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.9 mmt180 -121.48 175.74 6.04 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-N 111.522 -2.581 . . . . 0.0 111.732 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -57.84 127.56 32.67 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -173.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 76.39 29.59 0.7 Allowed 'General case' 0 N--CA 1.504 2.268 0 C-N-CA 125.194 1.398 . . . . 0.0 113.593 -172.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.6 t -124.85 149.6 47.31 Favored 'General case' 0 CA--C 1.566 1.581 0 O-C-N 120.485 -1.385 . . . . 0.0 112.123 175.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -77.85 104.76 8.6 Favored 'General case' 0 CA--C 1.572 1.791 0 CA-C-O 123.533 1.635 . . . . 0.0 113.207 -177.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -101.22 167.58 10.11 Favored 'General case' 0 CA--C 1.575 1.911 0 C-N-CA 125.901 1.68 . . . . 0.0 111.794 173.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.0 t -86.51 -86.7 0.14 Allowed 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 104.984 -2.228 . . . . 0.0 104.984 170.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -156.34 -74.51 0.1 Allowed 'General case' 0 CA--C 1.565 1.557 0 CA-C-N 120.513 1.506 . . . . 0.0 112.606 172.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 23.3 p90 -137.58 177.53 7.8 Favored 'General case' 0 CA--C 1.574 1.875 0 C-N-CA 124.013 0.925 . . . . 0.0 111.548 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.1 p -87.89 135.22 33.49 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.599 -1.313 . . . . 0.0 113.634 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.588 HD12 ' H ' ' A' ' 55' ' ' TYR . 1.0 OUTLIER -100.98 -121.49 0.16 Allowed 'General case' 0 CA--C 1.566 1.563 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 172.533 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.588 ' H ' HD12 ' A' ' 54' ' ' LEU . 60.3 t80 -144.64 74.36 1.41 Allowed 'General case' 0 CA--C 1.57 1.732 0 N-CA-C 103.663 -2.717 . . . . 0.0 103.663 171.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 168.2 -171.57 42.54 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 116.217 1.247 . . . . 0.0 116.217 -174.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.605 HG12 ' HB2' ' A' ' 30' ' ' HIS . 4.4 t -77.65 142.29 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 CA-C-O 122.779 1.276 . . . . 0.0 111.103 -172.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -115.37 126.55 54.55 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.075 -172.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -59.61 -40.99 89.37 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 175.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -142.49 113.24 7.42 Favored 'General case' 0 CA--C 1.56 1.365 0 N-CA-C 102.891 -3.003 . . . . 0.0 102.891 171.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 59.0 m -52.02 144.14 21.61 Favored Pre-proline 0 CA--C 1.586 2.358 0 N-CA-C 115.796 1.776 . . . . 0.0 115.796 -177.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -68.26 179.62 2.81 Favored 'Trans proline' 0 CA--C 1.568 2.187 0 C-N-CA 122.284 1.989 . . . . 0.0 116.411 -174.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 56.7 m -74.06 149.03 41.4 Favored 'General case' 0 CA--C 1.573 1.84 0 O-C-N 121.029 -1.044 . . . . 0.0 112.682 174.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.51 176.51 2.85 Favored 'General case' 0 CA--C 1.583 2.233 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 177.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.4 113.66 4.26 Favored 'General case' 0 CA--C 1.579 2.062 0 O-C-N 119.866 -1.771 . . . . 0.0 112.983 178.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 122.49 -39.11 2.36 Favored Glycine 0 N--CA 1.497 2.737 0 CA-C-N 113.923 -1.49 . . . . 0.0 116.079 -173.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 mp -98.4 151.77 20.2 Favored 'General case' 0 CA--C 1.567 1.604 0 CA-C-O 122.732 1.253 . . . . 0.0 112.704 -177.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -111.23 151.83 27.82 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.158 -0.964 . . . . 0.0 111.407 -179.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 4.0 t -90.65 117.76 29.56 Favored 'General case' 0 CA--C 1.569 1.685 0 C-N-CA 122.827 0.451 . . . . 0.0 111.991 175.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 . . . . . 0 N--CA 1.496 1.839 0 O-C-N 120.617 -1.302 . . . . 0.0 109.86 -176.715 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 123.3 1.524 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -153.71 168.25 32.21 Favored Glycine 0 N--CA 1.48 1.59 0 CA-C-N 115.246 -0.888 . . . . 0.0 114.735 -175.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 23.8 mm -97.9 132.43 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.15 -1.206 . . . . 0.0 109.577 -176.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.2 m -67.12 125.83 27.25 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 174.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -143.23 158.95 43.17 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 123.105 1.431 . . . . 0.0 111.832 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -93.81 74.66 4.25 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 123.54 1.638 . . . . 0.0 111.511 -174.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 N--CA 1.504 2.253 0 CA-C-N 113.693 -1.594 . . . . 0.0 115.048 -176.782 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.576 1.973 0 N-CA-C 116.959 2.207 . . . . 0.0 116.959 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.2 tp -159.39 125.15 4.29 Favored 'General case' 0 CA--C 1.579 2.091 0 N-CA-C 105.744 -1.947 . . . . 0.0 105.744 173.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -80.44 165.52 22.12 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 118.874 -2.391 . . . . 0.0 113.486 -175.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.17 144.01 44.99 Favored 'General case' 0 CA--C 1.576 1.974 0 O-C-N 120.962 -1.086 . . . . 0.0 110.037 174.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.79 25.06 26.1 Favored Glycine 0 CA--C 1.563 3.042 0 N-CA-C 114.769 0.668 . . . . 0.0 114.769 -171.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -136.15 148.4 48.18 Favored 'General case' 0 CA--C 1.571 1.762 0 C-N-CA 125.462 1.505 . . . . 0.0 109.132 -178.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 tt -69.1 117.75 11.14 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.59 -1.319 . . . . 0.0 112.284 -176.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 26.5 p -117.42 152.88 34.08 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 121.797 0.808 . . . . 0.0 113.054 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.0 mp -89.87 -78.72 0.36 Allowed 'General case' 0 CA--C 1.568 1.64 0 N-CA-C 106.348 -1.723 . . . . 0.0 106.348 172.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -96.46 168.86 10.29 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 120.59 1.541 . . . . 0.0 114.512 174.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.5 t -70.25 -21.93 62.93 Favored 'General case' 0 N--CA 1.506 2.355 0 N-CA-C 116.332 1.975 . . . . 0.0 116.332 174.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.17 16.74 0.54 Allowed 'General case' 0 CA--C 1.575 1.919 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 174.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 67.7 mt-30 -104.29 -39.66 6.4 Favored 'General case' 0 CA--C 1.572 1.813 0 C-N-CA 125.005 1.322 . . . . 0.0 113.177 173.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.0 m -80.7 149.04 29.9 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 115.54 1.682 . . . . 0.0 115.54 -177.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -57.02 -54.55 45.44 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.114 0.966 . . . . 0.0 110.544 172.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 91.9 p -82.42 101.28 10.54 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 103.766 -2.679 . . . . 0.0 103.766 168.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -69.39 80.47 0.38 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 125.267 2.46 . . . . 0.0 113.89 -172.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.2 t -156.93 82.41 0.94 Allowed 'General case' 0 CA--C 1.56 1.354 0 CA-C-N 112.096 -2.32 . . . . 0.0 110.729 -173.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 29.7 t -81.5 109.08 15.63 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 105.418 -2.068 . . . . 0.0 105.418 172.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.58 123.29 34.11 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-O 122.453 1.12 . . . . 0.0 112.726 -172.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.499 ' HB2' HG12 ' A' ' 57' ' ' VAL . 17.0 t60 -82.02 149.04 28.31 Favored 'General case' 0 CA--C 1.559 1.296 0 CA-C-O 122.707 1.241 . . . . 0.0 113.732 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -65.92 -1.26 2.84 Favored 'General case' 0 CA--C 1.585 2.317 0 N-CA-C 116.279 1.955 . . . . 0.0 116.279 171.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.266 64.9 p 68.84 85.75 0.14 Allowed 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 127.192 2.197 . . . . 0.0 110.384 -178.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.276 5.3 mp 77.41 140.78 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.587 2.379 0 C-N-CA 125.426 1.49 . . . . 0.0 109.364 -173.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.309 10.0 tp 84.94 -138.24 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.103 0 C-N-CA 126.455 1.902 . . . . 0.0 109.19 -174.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 96.4 p -165.3 96.61 0.69 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 121.445 1.929 . . . . 0.0 114.218 178.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 54.6 tp -150.35 89.25 1.56 Allowed 'General case' 0 CA--C 1.564 1.503 0 N-CA-C 103.925 -2.62 . . . . 0.0 103.925 173.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.8 m -104.51 132.85 50.28 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 122.832 1.301 . . . . 0.0 113.394 -172.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -136.93 133.56 35.82 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.528 1.131 . . . . 0.0 108.822 -177.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 55.2 m -66.57 146.46 54.48 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 124.341 2.019 . . . . 0.0 113.703 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -138.25 -178.08 5.12 Favored 'General case' 0 CA--C 1.564 1.483 0 CA-C-N 112.615 -2.084 . . . . 0.0 112.338 -174.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.5 tp -83.83 125.09 31.62 Favored 'General case' 0 CA--C 1.569 1.706 0 O-C-N 121.313 -0.867 . . . . 0.0 111.05 174.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -61.02 148.5 39.98 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 123.891 0.876 . . . . 0.0 112.508 174.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.21 152.53 42.17 Favored 'General case' 0 CA--C 1.564 1.517 0 N-CA-C 118.529 2.788 . . . . 0.0 118.529 -170.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.63 168.09 9.31 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 112.82 -1.991 . . . . 0.0 111.45 -174.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -51.59 139.42 20.57 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -178.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.354 10.9 p30 57.75 28.9 16.57 Favored 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -172.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.9 m -129.43 153.1 48.27 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-O 122.691 1.234 . . . . 0.0 110.55 174.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -69.5 137.27 52.4 Favored 'General case' 0 CA--C 1.578 2.044 0 CA-C-O 124.631 2.158 . . . . 0.0 115.354 -175.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 27.3 p -142.0 147.59 37.16 Favored 'General case' 0 CA--C 1.566 1.592 0 CA-C-N 112.241 -2.254 . . . . 0.0 110.691 -178.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 60.2 m -77.62 104.48 8.18 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 119.707 -1.871 . . . . 0.0 108.025 174.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.465 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . . . -78.85 43.93 0.52 Allowed 'General case' 0 CA--C 1.573 1.855 0 N-CA-C 118.732 2.864 . . . . 0.0 118.732 -173.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.9 p90 -164.29 138.01 5.3 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 126.096 1.758 . . . . 0.0 107.834 -174.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.5 p -114.21 137.68 51.46 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-O 122.883 1.325 . . . . 0.0 109.96 174.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.275 2.1 pp -96.22 -78.74 0.46 Allowed 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 113.821 -1.536 . . . . 0.0 108.48 176.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -159.84 -14.67 0.06 Allowed 'General case' 0 CA--C 1.587 2.378 0 C-N-CA 125.584 1.554 . . . . 0.0 112.757 176.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -164.59 -93.05 0.09 OUTLIER Glycine 0 N--CA 1.478 1.496 0 O-C-N 120.127 -1.608 . . . . 0.0 115.87 -174.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.499 HG12 ' HB2' ' A' ' 30' ' ' HIS . 1.9 t -79.28 143.94 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.191 0 CA-C-N 119.18 1.49 . . . . 0.0 112.243 -164.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -126.86 144.05 51.09 Favored 'General case' 0 CA--C 1.56 1.346 0 N-CA-C 114.96 1.466 . . . . 0.0 114.96 -172.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -69.65 -44.65 70.14 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.832 173.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -139.13 115.86 10.74 Favored 'General case' 0 CA--C 1.565 1.553 0 N-CA-C 102.783 -3.043 . . . . 0.0 102.783 173.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 58.2 m -53.5 145.71 27.16 Favored Pre-proline 0 CA--C 1.591 2.548 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 -174.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -79.0 65.57 8.85 Favored 'Trans proline' 0 CA--C 1.571 2.372 0 C-N-CA 123.498 2.799 . . . . 0.0 117.42 -173.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 58.1 m 58.97 165.17 0.05 OUTLIER 'General case' 0 CA--C 1.579 2.086 0 N-CA-C 117.048 2.24 . . . . 0.0 117.048 176.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -72.61 149.71 43.7 Favored 'General case' 0 CA--C 1.567 1.627 0 O-C-N 120.818 -1.176 . . . . 0.0 112.978 174.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.73 103.98 0.98 Allowed 'General case' 0 N--CA 1.499 2.003 0 CA-C-O 122.83 1.3 . . . . 0.0 112.368 -174.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 131.09 -32.01 3.07 Favored Glycine 0 CA--C 1.558 2.774 0 CA-C-N 114.344 -1.298 . . . . 0.0 114.58 -171.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mp -96.77 151.5 19.58 Favored 'General case' 0 CA--C 1.566 1.59 0 CA-C-O 122.77 1.271 . . . . 0.0 111.456 172.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -99.36 154.53 18.12 Favored 'General case' 0 CA--C 1.562 1.404 0 CA-C-O 122.291 1.043 . . . . 0.0 112.142 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.465 ' SG ' ' HB2' ' A' ' 51' ' ' ALA . 17.2 t -93.71 118.43 31.4 Favored 'General case' 0 CA--C 1.569 1.68 0 CA-C-N 115.327 -0.851 . . . . 0.0 108.79 172.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 . . . . . 0 CA--C 1.57 1.732 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -172.667 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 99.5 m-85 . . . . . 0 CA--C 1.573 1.861 0 CA-C-O 121.959 0.885 . . . . 0.0 111.816 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -55.96 154.11 14.81 Favored Glycine 0 N--CA 1.499 2.87 0 N-CA-C 117.712 1.845 . . . . 0.0 117.712 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 42.6 mm -99.8 137.13 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 O-C-N 120.668 -1.489 . . . . 0.0 110.804 -172.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 67.3 m -68.72 124.25 23.14 Favored 'General case' 0 CA--C 1.572 1.814 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 174.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 69.9 m-70 -141.47 163.11 33.82 Favored 'General case' 0 CA--C 1.565 1.539 0 O-C-N 120.628 -1.295 . . . . 0.0 111.048 178.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -95.82 85.45 4.11 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 123.483 1.611 . . . . 0.0 111.981 -175.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 48.0 t . . . . . 0 N--CA 1.497 1.903 0 CA-C-N 113.535 -1.666 . . . . 0.0 106.862 177.046 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.304 1.0 OUTLIER . . . . . 0 N--CA 1.507 2.39 0 N-CA-C 118.918 2.933 . . . . 0.0 118.918 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.1 mp -99.01 123.07 43.05 Favored 'General case' 0 CA--C 1.567 1.625 0 CA-C-O 122.778 1.275 . . . . 0.0 112.052 175.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -84.78 169.92 13.73 Favored 'General case' 0 CA--C 1.574 1.892 0 O-C-N 121.129 -0.982 . . . . 0.0 111.087 172.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.77 123.58 17.44 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.621 -1.3 . . . . 0.0 111.471 175.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 111.12 -6.2 28.83 Favored Glycine 0 CA--C 1.559 2.804 0 N-CA-C 117.157 1.623 . . . . 0.0 117.157 -172.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -99.09 135.73 40.08 Favored 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 119.635 1.718 . . . . 0.0 111.857 -178.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.6 tt -76.04 128.04 34.2 Favored 'General case' 0 CA--C 1.575 1.924 0 O-C-N 121.46 -0.775 . . . . 0.0 112.183 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.6 p -120.7 -171.78 2.25 Favored 'General case' 0 CA--C 1.577 1.998 0 CA-C-O 123.206 1.479 . . . . 0.0 114.702 -174.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.6 mt -112.29 -75.92 0.6 Allowed 'General case' 0 CA--C 1.578 2.025 0 N-CA-C 103.815 -2.661 . . . . 0.0 103.815 169.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.1 p30 -93.91 -177.67 4.41 Favored 'General case' 0 CA--C 1.589 2.47 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 172.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.0 m -84.95 -17.66 36.99 Favored 'General case' 0 N--CA 1.508 2.428 0 N-CA-C 116.289 1.959 . . . . 0.0 116.289 173.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.25 7.4 2.82 Favored 'General case' 0 CA--C 1.583 2.241 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 173.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -94.4 -40.78 9.75 Favored 'General case' 0 CA--C 1.568 1.66 0 C-N-CA 126.17 1.788 . . . . 0.0 110.862 173.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.7 m -76.24 117.18 17.66 Favored 'General case' 0 CA--C 1.566 1.586 0 CA-C-N 119.449 1.022 . . . . 0.0 109.604 173.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -77.63 9.56 3.3 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 118.007 2.595 . . . . 0.0 118.007 -174.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 65.0 p -81.15 -88.32 0.08 Allowed 'General case' 0 CA--C 1.581 2.152 0 N-CA-C 104.346 -2.464 . . . . 0.0 104.346 169.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -171.41 25.71 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.167 0 C-N-CA 125.996 1.718 . . . . 0.0 111.056 171.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 5.9 t -161.51 120.57 2.46 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 119.003 2.964 . . . . 0.0 119.003 -170.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 35.4 t -103.4 119.99 39.94 Favored 'General case' 0 CA--C 1.56 1.352 0 N-CA-C 102.651 -3.092 . . . . 0.0 102.651 167.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -93.31 115.37 27.95 Favored 'General case' 0 CA--C 1.562 1.425 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 -172.191 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.639 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.9 t-160 -84.04 114.6 21.85 Favored 'General case' 0 CA--C 1.567 1.596 0 C-N-CA 124.55 1.14 . . . . 0.0 112.228 -178.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -82.78 89.75 6.82 Favored 'General case' 0 CA--C 1.571 1.768 0 O-C-N 119.927 -1.733 . . . . 0.0 111.439 174.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.305 5.6 t 52.6 -177.0 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -176.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 28.5 mm -57.65 -28.78 32.91 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.607 0 O-C-N 118.937 -2.352 . . . . 0.0 114.812 -179.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.6 mt -51.98 -21.91 3.5 Favored 'General case' 0 N--CA 1.503 2.177 0 N-CA-C 118.544 2.794 . . . . 0.0 118.544 174.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.406 39.2 p 100.19 -122.65 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 127.67 2.388 . . . . 0.0 112.187 174.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 31.0 tp 45.48 76.84 0.09 Allowed 'General case' 0 N--CA 1.504 2.233 0 CA-C-N 120.426 1.466 . . . . 0.0 112.978 -173.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 48.6 m -98.14 108.23 20.89 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-O 122.023 0.916 . . . . 0.0 112.51 -172.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 34.2 ttm105 -118.17 136.55 53.56 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 124.091 0.956 . . . . 0.0 110.331 -176.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 62.6 m -62.92 154.21 31.01 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 117.59 2.441 . . . . 0.0 117.59 -174.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.95 -175.8 4.36 Favored 'General case' 0 CA--C 1.572 1.791 0 CA-C-N 112.713 -2.04 . . . . 0.0 112.443 -177.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.8 tp -116.88 171.88 7.61 Favored 'General case' 0 CA--C 1.572 1.821 0 O-C-N 121.204 -0.935 . . . . 0.0 110.929 176.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -56.32 145.35 27.27 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.814 -1.179 . . . . 0.0 113.706 174.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.1 149.62 35.7 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-O 123.928 1.823 . . . . 0.0 115.267 -174.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 44.4 mtp180 -107.68 169.19 8.74 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-N 112.715 -2.039 . . . . 0.0 111.731 -178.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -51.18 125.52 14.19 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -174.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 77.84 7.76 2.6 Favored 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -173.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.0 t -102.46 157.25 17.05 Favored 'General case' 0 CA--C 1.564 1.498 0 CA-C-O 123.104 1.431 . . . . 0.0 112.472 174.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -76.96 107.11 9.07 Favored 'General case' 0 CA--C 1.567 1.629 0 CA-C-O 123.218 1.485 . . . . 0.0 114.477 -173.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 23.1 p -114.96 147.61 39.81 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 113.373 -1.739 . . . . 0.0 113.237 176.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.0 t -104.8 130.82 52.83 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 170.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.85 -39.11 66.79 Favored 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 176.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -95.01 160.13 14.71 Favored 'General case' 0 CA--C 1.574 1.871 0 C-N-CA 125.541 1.536 . . . . 0.0 110.18 172.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 35.7 p -128.98 152.32 48.72 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-O 123.592 1.663 . . . . 0.0 110.434 173.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -97.38 -59.35 1.8 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 114.133 -1.394 . . . . 0.0 112.187 175.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -164.68 -52.31 0.03 OUTLIER 'General case' 0 CA--C 1.572 1.804 0 C-N-CA 126.195 1.798 . . . . 0.0 109.476 -176.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 100.69 102.4 2.52 Favored Glycine 0 CA--C 1.542 1.756 0 CA-C-O 122.754 1.197 . . . . 0.0 114.749 -177.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.639 HG12 ' HB2' ' A' ' 30' ' ' HIS . 13.8 t -103.58 141.33 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.123 0 O-C-N 118.09 -3.006 . . . . 0.0 107.704 83.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -113.4 133.91 54.92 Favored 'General case' 0 CA--C 1.553 1.058 0 N-CA-C 116.691 2.108 . . . . 0.0 116.691 -171.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -85.3 6.1 27.71 Favored 'General case' 0 CA--C 1.595 2.694 0 CA-C-N 115.04 -0.982 . . . . 0.0 113.482 169.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.85 102.95 0.79 Allowed 'General case' 0 CA--C 1.57 1.745 0 C-N-CA 127.563 2.345 . . . . 0.0 107.104 -171.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 95.6 m -67.56 131.95 92.92 Favored Pre-proline 0 CA--C 1.581 2.161 0 O-C-N 118.827 -2.42 . . . . 0.0 113.216 175.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -48.95 152.1 4.99 Favored 'Trans proline' 0 CA--C 1.569 2.227 0 C-N-CA 122.949 2.433 . . . . 0.0 116.68 175.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 1.8 t -74.25 150.68 40.14 Favored 'General case' 0 CA--C 1.572 1.826 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -173.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -67.76 162.38 24.0 Favored 'General case' 0 CA--C 1.574 1.886 0 N-CA-C 115.872 1.804 . . . . 0.0 115.872 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -64.25 119.05 9.54 Favored 'General case' 0 CA--C 1.572 1.808 0 O-C-N 120.735 -1.228 . . . . 0.0 111.754 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.91 -32.2 6.72 Favored Glycine 0 N--CA 1.494 2.56 0 CA-C-N 114.687 -1.142 . . . . 0.0 115.738 -172.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.6 mp -99.4 143.19 29.94 Favored 'General case' 0 CA--C 1.563 1.473 0 CA-C-O 122.798 1.285 . . . . 0.0 111.251 176.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.7 150.13 21.53 Favored 'General case' 0 CA--C 1.561 1.37 0 CA-C-O 122.449 1.118 . . . . 0.0 111.428 179.033 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 7.7 t -97.06 114.84 26.52 Favored 'General case' 0 CA--C 1.567 1.606 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.579 173.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 . . . . . 0 N--CA 1.498 1.942 0 O-C-N 120.476 -1.39 . . . . 0.0 109.835 177.218 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 . . . . . 0 CA--C 1.572 1.812 0 CA-C-O 121.772 0.796 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -141.84 -174.79 14.8 Favored Glycine 0 N--CA 1.493 2.466 0 O-C-N 119.778 -1.826 . . . . 0.0 116.822 176.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.6 mm -126.49 142.95 41.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 CA-C-O 122.101 0.953 . . . . 0.0 110.081 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 8.0 m -73.83 127.77 33.73 Favored 'General case' 0 CA--C 1.569 1.71 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 173.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 72.3 m-70 -140.52 155.86 46.5 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.824 -1.172 . . . . 0.0 109.623 174.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -92.41 81.14 4.89 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 119.528 -1.982 . . . . 0.0 113.064 -173.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 72.5 t . . . . . 0 N--CA 1.502 2.163 0 CA-C-N 112.685 -2.052 . . . . 0.0 112.865 -179.411 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 . . . . . 0 N--CA 1.507 2.387 0 N-CA-C 116.135 1.902 . . . . 0.0 116.135 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 36.7 tp -115.15 123.5 49.09 Favored 'General case' 0 CA--C 1.576 1.964 0 O-C-N 120.578 -1.327 . . . . 0.0 111.649 -177.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -66.1 162.81 18.83 Favored 'General case' 0 CA--C 1.576 1.976 0 O-C-N 119.757 -1.84 . . . . 0.0 115.624 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.31 130.38 44.24 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-O 121.928 0.87 . . . . 0.0 111.123 174.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 116.74 -13.8 14.8 Favored Glycine 0 CA--C 1.557 2.711 0 N-CA-C 116.844 1.498 . . . . 0.0 116.844 -172.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -103.98 151.15 23.54 Favored 'General case' 0 CA--C 1.567 1.627 0 CA-C-N 119.123 1.461 . . . . 0.0 112.716 -176.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.0 tt -73.33 123.43 23.76 Favored 'General case' 0 CA--C 1.574 1.888 0 O-C-N 121.308 -0.87 . . . . 0.0 112.095 -178.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.4 p -123.57 155.13 38.22 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 -176.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 mp -89.22 -76.67 0.4 Allowed 'General case' 0 CA--C 1.568 1.666 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 174.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -95.68 170.06 9.59 Favored 'General case' 0 CA--C 1.576 1.965 0 N-CA-C 114.414 1.264 . . . . 0.0 114.414 173.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 66.8 m -76.87 -21.58 54.74 Favored 'General case' 0 N--CA 1.507 2.381 0 N-CA-C 117.244 2.313 . . . . 0.0 117.244 176.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.79 7.26 3.23 Favored 'General case' 0 CA--C 1.583 2.229 0 N-CA-C 116.813 2.153 . . . . 0.0 116.813 174.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -96.2 -24.88 16.04 Favored 'General case' 0 CA--C 1.57 1.716 0 N-CA-C 115.662 1.727 . . . . 0.0 115.662 176.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 18.6 m -78.27 171.69 14.69 Favored 'General case' 0 CA--C 1.58 2.131 0 CA-C-N 121.029 1.74 . . . . 0.0 114.161 177.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -68.41 -65.37 0.71 Allowed 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.516 -1.365 . . . . 0.0 108.234 172.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 57.7 m -83.28 109.36 17.19 Favored 'General case' 0 CA--C 1.565 1.537 0 N-CA-C 101.157 -3.645 . . . . 0.0 101.157 168.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -67.66 82.36 0.18 Allowed 'General case' 0 N--CA 1.503 2.201 0 CA-C-O 125.158 2.409 . . . . 0.0 114.833 -171.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.8 t -145.25 77.39 1.52 Allowed 'General case' 0 CA--C 1.562 1.415 0 CA-C-N 111.549 -2.569 . . . . 0.0 112.482 -172.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.9 t -79.38 117.41 20.34 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 103.862 -2.644 . . . . 0.0 103.862 171.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.39 111.18 23.49 Favored 'General case' 0 CA--C 1.566 1.588 0 CA-C-O 123.256 1.503 . . . . 0.0 114.726 -169.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.517 ' HB2' HG12 ' A' ' 57' ' ' VAL . 0.1 OUTLIER -85.56 172.1 11.21 Favored 'General case' 0 CA--C 1.572 1.803 0 C-N-CA 126.514 1.926 . . . . 0.0 111.82 174.744 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -76.1 -62.91 1.44 Allowed 'General case' 0 CA--C 1.588 2.407 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 169.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.6 p -147.26 -92.45 0.09 Allowed 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 102.329 -3.211 . . . . 0.0 102.329 172.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 92.3 mt -119.07 -12.13 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.567 0 CA-C-N 121.661 2.028 . . . . 0.0 113.318 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.9 tp -127.3 94.71 4.07 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 122.652 2.478 . . . . 0.0 112.214 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.7 p -172.43 164.7 5.71 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 124.473 1.109 . . . . 0.0 112.949 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 15.6 tp -75.56 121.45 22.42 Favored 'General case' 0 CA--C 1.574 1.892 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 171.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.4 m -95.69 138.89 32.71 Favored 'General case' 0 CA--C 1.569 1.693 0 O-C-N 121.246 -0.909 . . . . 0.0 113.304 -172.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 18.5 ttp180 -132.64 144.07 50.09 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.377 -0.827 . . . . 0.0 111.831 -175.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 71.6 m -63.76 138.4 58.47 Favored 'General case' 0 CA--C 1.566 1.574 0 O-C-N 119.676 -1.89 . . . . 0.0 113.302 175.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -138.88 -172.14 3.25 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-N 113.937 -1.483 . . . . 0.0 113.243 -173.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.5 mt -89.2 151.14 22.33 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-O 122.261 1.029 . . . . 0.0 112.74 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.15 152.66 36.64 Favored 'General case' 0 CA--C 1.572 1.825 0 O-C-N 121.619 -0.676 . . . . 0.0 112.525 173.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.476 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . . . -79.93 171.14 15.51 Favored 'General case' 0 CA--C 1.573 1.833 0 CA-C-O 123.435 1.588 . . . . 0.0 114.186 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -118.83 164.97 14.62 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 122.897 1.332 . . . . 0.0 112.304 -174.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -61.24 137.77 58.23 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.299 -0.875 . . . . 0.0 113.209 178.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 64.58 26.37 13.27 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -173.096 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 52.4 m -123.01 149.62 44.09 Favored 'General case' 0 CA--C 1.561 1.378 0 CA-C-O 122.929 1.347 . . . . 0.0 110.186 174.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -75.63 102.13 5.22 Favored 'General case' 0 CA--C 1.576 1.945 0 CA-C-O 124.213 1.959 . . . . 0.0 114.131 -176.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.446 ' SG ' ' HA ' ' A' ' 62' ' ' PRO . 4.4 t -95.29 149.61 21.16 Favored 'General case' 0 CA--C 1.565 1.543 0 CA-C-O 124.066 1.889 . . . . 0.0 111.122 173.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.7 p -93.33 113.01 25.09 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 114.405 -1.27 . . . . 0.0 108.307 174.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.4 -8.32 59.02 Favored 'General case' 0 CA--C 1.563 1.462 0 N-CA-C 117.426 2.38 . . . . 0.0 117.426 -175.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . 0.334 0.2 OUTLIER -94.65 176.12 6.4 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 117.383 2.364 . . . . 0.0 117.383 -174.513 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.4 m 79.04 -147.08 0.02 OUTLIER 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 100.793 -3.78 . . . . 0.0 100.793 -167.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 54' ' ' LEU 0.596 2.8 mm? -177.98 -77.0 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.025 0 O-C-N 116.991 -3.568 . . . . 0.0 110.583 162.243 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -77.87 -20.31 53.25 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.91 -1.119 . . . . 0.0 112.607 171.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -90.0 -152.42 26.87 Favored Glycine 0 CA--C 1.55 2.242 0 CA-C-O 123.338 1.521 . . . . 0.0 112.507 172.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.517 HG12 ' HB2' ' A' ' 30' ' ' HIS . 10.0 t -84.62 139.41 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 CA-C-O 123.026 1.394 . . . . 0.0 114.038 -165.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -105.65 156.16 18.54 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -174.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -90.91 -68.07 0.81 Allowed 'General case' 0 N--CA 1.503 2.215 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 -175.042 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -116.91 96.03 5.28 Favored 'General case' 0 CA--C 1.567 1.616 0 N-CA-C 101.747 -3.427 . . . . 0.0 101.747 170.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 66.9 m -39.03 149.86 0.23 Allowed Pre-proline 0 CA--C 1.578 2.03 0 N-CA-C 120.547 3.536 . . . . 0.0 120.547 -173.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.446 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 78.8 Cg_endo -65.63 170.9 10.41 Favored 'Trans proline' 0 CA--C 1.568 2.197 0 C-N-CA 122.223 1.949 . . . . 0.0 114.552 174.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.476 ' SG ' ' HB3' ' A' ' 43' ' ' ALA . 95.3 m -88.76 178.37 6.48 Favored 'General case' 0 CA--C 1.571 1.758 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 -174.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -61.55 174.53 0.75 Allowed 'General case' 0 CA--C 1.579 2.092 0 N-CA-C 117.494 2.405 . . . . 0.0 117.494 -174.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 24.6 tpt180 -61.02 111.63 1.76 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.124 -1.61 . . . . 0.0 113.136 -175.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 96.79 -19.74 53.49 Favored Glycine 0 N--CA 1.499 2.88 0 N-CA-C 116.892 1.517 . . . . 0.0 116.892 -172.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.94 120.35 38.17 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 124.804 1.242 . . . . 0.0 108.603 176.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.81 164.31 12.62 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 115.532 1.679 . . . . 0.0 115.532 -172.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 14.4 t -91.8 104.41 16.86 Favored 'General case' 0 CA--C 1.566 1.559 0 CA-C-N 113.306 -1.77 . . . . 0.0 107.32 171.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 . . . . . 0 N--CA 1.494 1.746 0 CA-C-N 121.525 1.966 . . . . 0.0 107.533 -177.792 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 . . . . . 0 CA--C 1.574 1.876 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -126.92 171.7 18.53 Favored Glycine 0 N--CA 1.494 2.507 0 O-C-N 120.915 -1.116 . . . . 0.0 114.397 175.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.6 mm -96.96 139.99 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.246 0 O-C-N 119.883 -1.951 . . . . 0.0 112.118 -168.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 3.8 m -74.3 131.92 41.61 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.249 -1.532 . . . . 0.0 114.39 173.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 64.7 m-70 -140.59 158.62 43.72 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 122.531 1.158 . . . . 0.0 110.98 177.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -95.94 130.21 42.98 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 120.964 -1.085 . . . . 0.0 111.623 -176.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.6 p . . . . . 0 N--CA 1.497 1.886 0 N-CA-C 114.719 1.377 . . . . 0.0 114.719 -173.407 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 . . . . . 0 N--CA 1.508 2.434 0 CA-C-O 121.416 0.627 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.73 139.9 51.99 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 123.363 1.554 . . . . 0.0 114.61 -176.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.5 156.88 30.71 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 122.241 1.02 . . . . 0.0 113.138 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -80.9 119.7 23.78 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 122.716 1.246 . . . . 0.0 109.02 -175.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 129.64 -20.61 5.16 Favored Glycine 0 CA--C 1.558 2.769 0 CA-C-N 114.222 -1.354 . . . . 0.0 114.692 -171.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.284 6.0 tp10 -99.62 158.85 15.47 Favored 'General case' 0 CA--C 1.572 1.802 0 CA-C-N 119.436 1.618 . . . . 0.0 112.036 -178.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.8 tp -75.37 135.44 40.81 Favored 'General case' 0 CA--C 1.578 2.028 0 O-C-N 120.963 -1.085 . . . . 0.0 113.714 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.9 p -133.85 159.74 39.75 Favored 'General case' 0 CA--C 1.564 1.514 0 C-N-CA 124.871 1.268 . . . . 0.0 112.361 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.7 mt -92.48 -77.14 0.44 Allowed 'General case' 0 CA--C 1.566 1.59 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 173.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.3 p30 -91.24 167.38 12.36 Favored 'General case' 0 CA--C 1.58 2.117 0 N-CA-C 115.43 1.641 . . . . 0.0 115.43 174.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.2 m -70.51 -20.79 62.81 Favored 'General case' 0 N--CA 1.509 2.52 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 174.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.96 4.45 5.37 Favored 'General case' 0 CA--C 1.579 2.088 0 N-CA-C 116.909 2.188 . . . . 0.0 116.909 174.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -94.83 -31.48 13.7 Favored 'General case' 0 CA--C 1.565 1.522 0 C-N-CA 125.082 1.353 . . . . 0.0 114.371 174.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 11.2 m -78.17 157.59 29.34 Favored 'General case' 0 CA--C 1.574 1.881 0 CA-C-N 121.703 2.047 . . . . 0.0 114.18 177.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -61.97 -57.07 13.1 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.753 -1.217 . . . . 0.0 109.506 172.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.7 m -83.82 110.6 18.48 Favored 'General case' 0 CA--C 1.567 1.597 0 N-CA-C 102.737 -3.06 . . . . 0.0 102.737 169.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -66.27 82.47 0.09 Allowed 'General case' 0 N--CA 1.502 2.141 0 CA-C-O 124.187 1.946 . . . . 0.0 114.153 -172.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.6 t -154.03 82.75 1.14 Allowed 'General case' 0 CA--C 1.567 1.611 0 CA-C-N 112.843 -1.98 . . . . 0.0 112.956 -173.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.9 t -85.6 111.86 20.44 Favored 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 104.231 -2.507 . . . . 0.0 104.231 171.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.15 123.06 43.16 Favored 'General case' 0 CA--C 1.561 1.388 0 CA-C-O 122.443 1.116 . . . . 0.0 112.841 -171.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -79.82 129.5 34.53 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.111 0.964 . . . . 0.0 112.404 -173.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -76.41 43.57 0.31 Allowed 'General case' 0 CA--C 1.583 2.218 0 N-CA-C 116.414 2.005 . . . . 0.0 116.414 174.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 43.7 p 61.03 88.28 0.09 Allowed 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 125.769 1.628 . . . . 0.0 114.306 174.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 23.6 mm 75.11 -57.19 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.613 0 C-N-CA 125.138 1.375 . . . . 0.0 113.264 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -42.67 -44.98 4.52 Favored 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 118.361 2.726 . . . . 0.0 118.361 -177.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.338 28.6 p 96.47 -4.91 0.07 Allowed 'General case' 0 N--CA 1.507 2.408 0 N-CA-C 118.81 2.893 . . . . 0.0 118.81 173.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 mp -74.61 95.35 2.8 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 121.926 2.148 . . . . 0.0 106.609 172.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.8 m -97.64 134.07 41.33 Favored 'General case' 0 CA--C 1.559 1.317 0 CA-C-N 114.661 -1.154 . . . . 0.0 113.67 -170.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 68.3 ttp85 -114.24 144.57 43.0 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.224 1.01 . . . . 0.0 111.687 -176.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 75.1 m -69.4 132.5 46.46 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 119.92 -1.737 . . . . 0.0 111.096 173.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.27 178.92 7.08 Favored 'General case' 0 CA--C 1.568 1.643 0 N-CA-C 115.151 1.537 . . . . 0.0 115.151 -173.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.571 HD13 ' H ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -86.82 160.29 18.81 Favored 'General case' 0 CA--C 1.573 1.842 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 178.054 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.59 156.63 25.08 Favored 'General case' 0 CA--C 1.582 2.173 0 CA-C-O 121.923 0.868 . . . . 0.0 112.533 175.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.01 166.21 21.79 Favored 'General case' 0 CA--C 1.572 1.819 0 N-CA-C 116.588 2.07 . . . . 0.0 116.588 -175.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 13.4 mtp-105 -131.33 171.39 13.41 Favored 'General case' 0 CA--C 1.564 1.519 0 CA-C-N 113.961 -1.472 . . . . 0.0 111.555 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -45.98 129.79 9.71 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 116.682 2.105 . . . . 0.0 116.682 -174.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 73.04 10.1 5.31 Favored 'General case' 0 N--CA 1.505 2.298 0 N-CA-C 115.623 1.712 . . . . 0.0 115.623 -174.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.0 t -107.92 159.49 16.49 Favored 'General case' 0 CA--C 1.567 1.607 0 CA-C-O 122.969 1.366 . . . . 0.0 111.286 174.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -71.39 128.4 35.73 Favored 'General case' 0 CA--C 1.563 1.466 0 CA-C-O 123.164 1.459 . . . . 0.0 114.006 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -122.37 128.53 51.09 Favored 'General case' 0 CA--C 1.561 1.387 0 CA-C-N 113.304 -1.771 . . . . 0.0 108.974 173.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.3 t -86.7 97.49 10.61 Favored 'General case' 0 CA--C 1.558 1.253 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.555 173.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.413 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . . . -78.52 76.63 5.02 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 123.616 1.674 . . . . 0.0 112.159 -176.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -144.67 153.74 42.06 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 117.419 2.378 . . . . 0.0 117.419 -171.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.1 p -149.25 135.96 19.54 Favored 'General case' 0 CA--C 1.558 1.267 0 CA-C-O 124.265 1.983 . . . . 0.0 106.3 169.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.287 1.9 pp -141.35 -80.11 0.25 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 112.982 -1.917 . . . . 0.0 105.917 -176.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -150.84 -1.42 0.37 Allowed 'General case' 0 CA--C 1.591 2.522 0 C-N-CA 126.409 1.883 . . . . 0.0 110.759 172.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 170.97 -83.71 0.08 OUTLIER Glycine 0 C--N 1.351 1.391 0 O-C-N 119.046 -2.284 . . . . 0.0 117.686 -173.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 2.4 t -78.39 137.05 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 CA-C-N 119.758 1.779 . . . . 0.0 113.035 -157.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -123.96 130.5 52.69 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.109 -1.405 . . . . 0.0 110.458 -173.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -62.54 -43.73 98.09 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -178.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.6 mptt -139.33 106.87 5.57 Favored 'General case' 0 CA--C 1.562 1.434 0 N-CA-C 103.519 -2.771 . . . . 0.0 103.519 173.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.0 m -49.65 147.78 5.82 Favored Pre-proline 0 CA--C 1.591 2.525 0 N-CA-C 117.058 2.244 . . . . 0.0 117.058 -174.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -60.75 172.35 2.92 Favored 'Trans proline' 0 CA--C 1.569 2.231 0 C-N-CA 122.877 2.385 . . . . 0.0 118.003 -173.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 35.3 m -73.0 161.69 30.39 Favored 'General case' 0 CA--C 1.573 1.833 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -174.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -62.53 156.73 22.2 Favored 'General case' 0 CA--C 1.577 2.007 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -61.73 109.45 1.22 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.745 -1.222 . . . . 0.0 113.495 -174.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.86 -24.82 18.35 Favored Glycine 0 N--CA 1.5 2.923 0 N-CA-C 116.502 1.361 . . . . 0.0 116.502 -172.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 tt -98.28 136.7 38.09 Favored 'General case' 0 CA--C 1.574 1.877 0 C-N-CA 124.897 1.279 . . . . 0.0 109.034 176.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.89 159.01 15.2 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 116.855 2.169 . . . . 0.0 116.855 -172.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.413 ' SG ' ' HB2' ' A' ' 51' ' ' ALA . 9.1 t -95.55 132.43 40.68 Favored 'General case' 0 CA--C 1.573 1.849 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.329 171.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.298 2.8 pp20? . . . . . 0 N--CA 1.506 2.339 0 CA-C-N 122.096 2.226 . . . . 0.0 112.169 177.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 122.097 0.951 . . . . 0.0 112.822 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.42 162.17 41.12 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 118.608 2.203 . . . . 0.0 118.608 175.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 19.6 mm -98.43 148.3 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.003 0 CA-C-O 122.587 1.184 . . . . 0.0 109.459 176.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.8 m -72.66 125.3 27.15 Favored 'General case' 0 CA--C 1.571 1.765 0 O-C-N 120.397 -1.439 . . . . 0.0 113.153 173.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 70.7 m-70 -140.51 152.29 45.46 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 120.245 -1.534 . . . . 0.0 111.573 176.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -96.94 122.57 40.06 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-O 122.102 0.953 . . . . 0.0 109.674 177.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 46.0 t . . . . . 0 N--CA 1.503 2.184 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -174.553 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 . . . . . 0 CA--C 1.582 2.204 0 N-CA-C 116.374 1.99 . . . . 0.0 116.374 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -149.68 146.05 27.04 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 123.34 1.543 . . . . 0.0 113.249 173.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -84.82 171.64 12.09 Favored 'General case' 0 CA--C 1.569 1.709 0 N-CA-C 114.071 1.138 . . . . 0.0 114.071 -178.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.21 127.51 31.62 Favored 'General case' 0 CA--C 1.575 1.906 0 O-C-N 121.14 -0.975 . . . . 0.0 111.466 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 117.41 -20.74 11.06 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 117.061 1.584 . . . . 0.0 117.061 -173.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -101.87 153.44 19.84 Favored 'General case' 0 CA--C 1.575 1.912 0 CA-C-N 119.064 1.432 . . . . 0.0 112.319 -179.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 tt -74.55 129.66 38.16 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.075 -1.016 . . . . 0.0 113.464 -174.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.6 p -127.02 151.24 48.86 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 124.272 1.029 . . . . 0.0 112.955 178.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.8 mp -87.79 -71.78 0.56 Allowed 'General case' 0 CA--C 1.57 1.719 0 O-C-N 120.946 -1.096 . . . . 0.0 108.46 173.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -95.25 173.48 7.53 Favored 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 120.531 1.514 . . . . 0.0 114.563 173.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.3 m -77.98 -19.1 55.11 Favored 'General case' 0 N--CA 1.505 2.282 0 N-CA-C 117.204 2.298 . . . . 0.0 117.204 176.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.91 10.69 2.64 Favored 'General case' 0 CA--C 1.58 2.131 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 172.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -94.41 -46.66 6.92 Favored 'General case' 0 CA--C 1.558 1.287 0 CA-C-O 117.67 -1.157 . . . . 0.0 113.071 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.9 m -65.87 149.24 50.51 Favored 'General case' 0 CA--C 1.576 1.959 0 CA-C-N 122.076 2.216 . . . . 0.0 113.685 178.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.0 mmmp? -59.37 -53.61 56.17 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 120.621 -1.3 . . . . 0.0 110.536 172.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 87.6 p -82.96 100.0 10.15 Favored 'General case' 0 CA--C 1.572 1.817 0 N-CA-C 102.179 -3.267 . . . . 0.0 102.179 167.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 51.6 m-80 -67.64 85.46 0.19 Allowed 'General case' 0 N--CA 1.501 2.12 0 CA-C-O 125.238 2.447 . . . . 0.0 114.611 -170.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 t -152.31 77.77 1.2 Allowed 'General case' 0 CA--C 1.562 1.424 0 CA-C-N 111.216 -2.72 . . . . 0.0 110.725 -173.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.3 t -82.1 111.16 17.98 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 172.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.52 130.28 46.57 Favored 'General case' 0 CA--C 1.556 1.193 0 CA-C-O 122.145 0.974 . . . . 0.0 111.338 -172.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -79.42 173.34 12.68 Favored 'General case' 0 CA--C 1.568 1.638 0 N-CA-C 114.894 1.442 . . . . 0.0 114.894 -173.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 44.6 p-10 -80.46 -63.98 1.29 Allowed 'General case' 0 CA--C 1.568 1.673 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 173.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.5 m -160.8 -83.76 0.04 OUTLIER 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 104.479 -2.415 . . . . 0.0 104.479 171.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 69.4 mt -123.53 -22.45 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.302 0 CA-C-N 120.116 1.325 . . . . 0.0 112.805 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.9 tp -76.89 -113.94 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 122.467 2.394 . . . . 0.0 111.642 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 95.3 p -161.05 101.67 1.26 Allowed 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 122.733 2.515 . . . . 0.0 115.571 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.8 tp -163.79 86.36 0.49 Allowed 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 103.821 -2.659 . . . . 0.0 103.821 172.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 11.8 m -105.77 129.56 53.94 Favored 'General case' 0 CA--C 1.566 1.576 0 CA-C-O 122.532 1.158 . . . . 0.0 112.712 -172.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 19.2 ttp180 -132.49 146.59 52.05 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.368 1.067 . . . . 0.0 110.655 -175.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 73.2 m -67.98 142.32 56.0 Favored 'General case' 0 CA--C 1.563 1.475 0 O-C-N 119.821 -1.799 . . . . 0.0 113.598 176.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.83 -173.81 3.81 Favored 'General case' 0 CA--C 1.569 1.693 0 CA-C-N 114.202 -1.363 . . . . 0.0 113.664 -174.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.9 mt -92.29 154.37 18.64 Favored 'General case' 0 CA--C 1.57 1.736 0 CA-C-O 122.47 1.128 . . . . 0.0 112.732 176.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.85 150.63 34.16 Favored 'General case' 0 CA--C 1.575 1.909 0 C-N-CA 123.648 0.779 . . . . 0.0 112.387 173.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.67 158.63 29.62 Favored 'General case' 0 CA--C 1.568 1.653 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 -173.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -115.23 168.59 9.82 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 113.464 -1.698 . . . . 0.0 111.414 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -53.55 130.16 35.02 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -174.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 72.05 27.91 2.6 Favored 'General case' 0 N--CA 1.506 2.338 0 C-N-CA 124.875 1.27 . . . . 0.0 114.101 -173.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.8 m -125.08 150.03 47.23 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.658 -1.277 . . . . 0.0 110.345 174.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -71.68 131.19 42.81 Favored 'General case' 0 CA--C 1.57 1.74 0 CA-C-O 122.941 1.353 . . . . 0.0 112.452 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.416 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 25.0 p -134.14 160.74 36.89 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-N 113.74 -1.573 . . . . 0.0 114.995 -174.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.1 m -79.38 101.94 8.41 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.892 0.854 . . . . 0.0 109.672 176.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -76.86 -47.56 20.93 Favored 'General case' 0 CA--C 1.571 1.783 0 N-CA-C 115.751 1.76 . . . . 0.0 115.751 -174.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -102.7 104.84 15.2 Favored 'General case' 0 CA--C 1.568 1.635 0 C-N-CA 124.599 1.16 . . . . 0.0 108.057 174.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.3 p -98.55 134.29 41.72 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 123.559 1.647 . . . . 0.0 113.799 -174.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -98.58 -170.83 2.01 Favored 'General case' 0 CA--C 1.578 2.031 0 CA-C-N 112.462 -2.153 . . . . 0.0 108.939 172.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -99.58 62.23 1.2 Allowed 'General case' 0 N--CA 1.501 2.119 0 CA-C-O 123.518 1.628 . . . . 0.0 108.38 174.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -169.49 -168.79 31.95 Favored Glycine 0 N--CA 1.475 1.275 0 CA-C-O 123.593 1.663 . . . . 0.0 114.149 -173.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.1 t -78.78 147.68 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 CA-C-O 123.215 1.483 . . . . 0.0 112.619 -163.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -117.09 138.34 51.69 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-N 114.313 -1.312 . . . . 0.0 113.396 -173.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -68.36 -33.16 73.77 Favored 'General case' 0 CA--C 1.589 2.479 0 O-C-N 121.256 -0.902 . . . . 0.0 112.697 172.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.56 109.65 3.72 Favored 'General case' 0 CA--C 1.566 1.59 0 N-CA-C 105.324 -2.102 . . . . 0.0 105.324 177.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 59.2 m -52.17 157.05 2.42 Favored Pre-proline 0 CA--C 1.591 2.551 0 N-CA-C 118.78 2.881 . . . . 0.0 118.78 -174.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -54.14 167.18 1.29 Allowed 'Trans proline' 0 CA--C 1.566 2.094 0 C-N-CA 123.374 2.716 . . . . 0.0 118.032 176.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.416 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 69.3 m -71.43 162.2 29.83 Favored 'General case' 0 CA--C 1.574 1.884 0 N-CA-C 115.028 1.492 . . . . 0.0 115.028 177.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -62.62 161.18 12.61 Favored 'General case' 0 CA--C 1.576 1.966 0 N-CA-C 115.624 1.712 . . . . 0.0 115.624 177.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 72.3 ttt180 -62.0 116.88 5.28 Favored 'General case' 0 CA--C 1.572 1.792 0 O-C-N 120.697 -1.252 . . . . 0.0 112.888 -175.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.29 -21.44 41.33 Favored Glycine 0 CA--C 1.559 2.842 0 N-CA-C 117.101 1.6 . . . . 0.0 117.101 -172.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 tp -99.78 141.27 32.8 Favored 'General case' 0 CA--C 1.572 1.814 0 C-N-CA 124.803 1.241 . . . . 0.0 111.545 -179.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -99.11 151.27 21.16 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.409 -1.432 . . . . 0.0 113.945 -174.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 13.1 t -95.41 99.12 11.08 Favored 'General case' 0 CA--C 1.57 1.715 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.49 172.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 . . . . . 0 N--CA 1.497 1.912 0 O-C-N 120.483 -1.386 . . . . 0.0 110.38 -179.766 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.0 m-30 . . . . . 0 N--CA 1.495 1.823 0 N-CA-C 116.216 1.932 . . . . 0.0 116.216 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -146.17 174.55 26.04 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 115.902 1.121 . . . . 0.0 115.902 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.8 mm -111.39 143.27 21.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 CA-C-O 122.17 0.986 . . . . 0.0 109.865 -177.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.413 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 69.4 m -71.04 120.61 16.85 Favored 'General case' 0 CA--C 1.569 1.701 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 174.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 71.8 m-70 -142.02 161.07 38.91 Favored 'General case' 0 CA--C 1.565 1.55 0 CA-C-O 123.349 1.547 . . . . 0.0 111.751 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -97.66 102.36 14.1 Favored 'General case' 0 CA--C 1.563 1.466 0 O-C-N 120.932 -1.105 . . . . 0.0 110.732 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 41.4 t . . . . . 0 N--CA 1.498 1.963 0 CA-C-O 122.354 1.074 . . . . 0.0 108.635 -175.1 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 . . . . . 0 N--CA 1.501 2.123 0 CA-C-O 122.409 1.099 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.439 ' H ' ' HA ' ' A' ' 23' ' ' CYS . 0.7 OUTLIER -125.83 149.85 48.31 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 123.402 1.572 . . . . 0.0 113.799 -177.847 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -79.5 165.05 23.42 Favored 'General case' 0 CA--C 1.573 1.832 0 O-C-N 120.944 -1.097 . . . . 0.0 112.358 174.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.21 132.64 44.37 Favored 'General case' 0 CA--C 1.574 1.868 0 O-C-N 120.611 -1.306 . . . . 0.0 111.348 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 116.28 13.89 8.0 Favored Glycine 0 CA--C 1.558 2.776 0 N-CA-C 115.705 1.042 . . . . 0.0 115.705 -172.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -129.49 152.3 49.17 Favored 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 119.187 1.493 . . . . 0.0 110.433 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 54.3 mt -72.28 125.94 28.58 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.095 -1.003 . . . . 0.0 113.304 -177.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.8 p -121.29 143.51 49.13 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 124.164 0.985 . . . . 0.0 112.271 -177.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.5 mt -78.77 -72.13 0.4 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.035 -1.04 . . . . 0.0 109.279 174.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 60.7 m-20 -99.03 -165.59 1.25 Allowed 'General case' 0 CA--C 1.578 2.046 0 CA-C-N 119.229 0.922 . . . . 0.0 112.551 172.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.1 t -82.8 -24.68 33.29 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 119.784 -1.822 . . . . 0.0 114.964 172.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.24 62.66 6.06 Favored 'General case' 0 CA--C 1.574 1.867 0 CA-C-O 125.057 2.36 . . . . 0.0 111.672 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -137.68 -59.49 0.67 Allowed 'General case' 0 CA--C 1.566 1.558 0 CA-C-N 111.531 -2.577 . . . . 0.0 109.929 -174.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.439 ' HA ' ' H ' ' A' ' 11' ' ' LEU . 71.9 m -83.29 155.03 23.82 Favored 'General case' 0 CA--C 1.57 1.734 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 175.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.6 mtpt -60.75 -53.51 56.51 Favored 'General case' 0 N--CA 1.502 2.147 0 C-N-CA 124.089 0.956 . . . . 0.0 109.877 171.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 92.2 p -81.88 101.84 10.48 Favored 'General case' 0 CA--C 1.569 1.689 0 N-CA-C 105.353 -2.091 . . . . 0.0 105.353 170.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -72.7 76.72 1.11 Allowed 'General case' 0 N--CA 1.501 2.121 0 CA-C-O 124.973 2.32 . . . . 0.0 113.418 -173.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 t -139.94 70.54 1.36 Allowed 'General case' 0 CA--C 1.562 1.427 0 CA-C-N 111.99 -2.368 . . . . 0.0 108.28 -178.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.2 t -78.0 108.75 11.5 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 173.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.18 120.16 39.46 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-O 122.861 1.315 . . . . 0.0 112.856 -171.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.46 ' HB2' HG12 ' A' ' 57' ' ' VAL . 1.9 t60 -82.18 153.6 25.89 Favored 'General case' 0 CA--C 1.563 1.48 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -174.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -76.8 8.2 3.94 Favored 'General case' 0 CA--C 1.586 2.352 0 N-CA-C 116.402 2.001 . . . . 0.0 116.402 172.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.277 44.3 p 75.81 97.07 0.07 Allowed 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 127.063 2.145 . . . . 0.0 111.681 -178.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.28 4.2 mp 75.27 -46.94 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 C-N-CA 125.565 1.546 . . . . 0.0 114.305 174.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.0 mp -77.83 -126.85 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.158 0 CA-C-N 121.565 1.984 . . . . 0.0 112.249 -174.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.1 p -156.84 94.6 1.45 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 122.924 2.602 . . . . 0.0 116.119 178.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 tt -161.28 92.75 0.92 Allowed 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 103.724 -2.695 . . . . 0.0 103.724 173.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.5 m -110.32 116.11 30.88 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.312 -0.868 . . . . 0.0 112.222 -173.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -124.12 137.55 54.54 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 124.242 1.017 . . . . 0.0 109.782 -178.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 98.5 m -68.58 142.39 55.19 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 119.989 -1.694 . . . . 0.0 113.46 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -135.35 -176.75 4.37 Favored 'General case' 0 CA--C 1.565 1.555 0 CA-C-N 113.558 -1.656 . . . . 0.0 113.183 -173.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.6 pp -82.29 161.9 22.47 Favored 'General case' 0 CA--C 1.572 1.799 0 CA-C-O 122.429 1.109 . . . . 0.0 112.807 174.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -77.97 152.99 32.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.213 -0.929 . . . . 0.0 112.713 175.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.62 159.0 30.65 Favored 'General case' 0 CA--C 1.569 1.697 0 CA-C-O 123.972 1.844 . . . . 0.0 115.278 -174.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 56.8 mtt85 -126.53 168.13 14.69 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-N 113.475 -1.693 . . . . 0.0 110.939 -177.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -44.51 135.21 4.87 Favored 'General case' 0 CA--C 1.574 1.884 0 N-CA-C 116.953 2.205 . . . . 0.0 116.953 -173.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.39 6.6 p30 67.88 14.04 9.32 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 116.957 2.206 . . . . 0.0 116.957 -173.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.5 t -117.41 146.29 43.54 Favored 'General case' 0 CA--C 1.565 1.546 0 CA-C-O 122.867 1.318 . . . . 0.0 110.56 173.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -60.11 139.68 57.35 Favored 'General case' 0 CA--C 1.571 1.753 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.611 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 28.5 p -141.88 150.74 41.93 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 113.289 -1.778 . . . . 0.0 114.692 -174.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.8 t -79.83 109.67 14.47 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 173.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.03 -43.46 64.95 Favored 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -105.23 144.71 31.64 Favored 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 170.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 22.3 p -126.79 139.03 53.41 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.196 -1.565 . . . . 0.0 112.295 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -98.39 -169.24 1.77 Allowed 'General case' 0 CA--C 1.576 1.965 0 CA-C-N 113.098 -1.864 . . . . 0.0 109.513 173.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -103.22 62.53 0.79 Allowed 'General case' 0 N--CA 1.499 2.016 0 CA-C-O 123.258 1.504 . . . . 0.0 108.017 174.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -162.61 177.4 38.74 Favored Glycine 0 N--CA 1.475 1.272 0 CA-C-N 113.554 -1.657 . . . . 0.0 112.012 -174.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.46 HG12 ' HB2' ' A' ' 30' ' ' HIS . 3.4 t -78.34 141.06 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 CA-C-O 123.396 1.569 . . . . 0.0 111.764 -167.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -107.54 136.53 47.16 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 114.165 -1.38 . . . . 0.0 112.964 -172.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -68.41 -19.94 64.63 Favored 'General case' 0 CA--C 1.592 2.572 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 172.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.67 111.97 1.21 Allowed 'General case' 0 CA--C 1.575 1.925 0 C-N-CA 128.038 2.535 . . . . 0.0 104.837 -175.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 40.2 m -58.64 155.49 29.34 Favored Pre-proline 0 CA--C 1.588 2.442 0 O-C-N 118.946 -2.346 . . . . 0.0 116.75 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -64.2 168.59 12.24 Favored 'Trans proline' 0 CA--C 1.573 2.434 0 C-N-CA 122.691 2.26 . . . . 0.0 115.678 175.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 60.9 m -73.94 150.26 40.91 Favored 'General case' 0 CA--C 1.575 1.94 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -177.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.71 -175.96 1.84 Allowed 'General case' 0 CA--C 1.583 2.23 0 N-CA-C 116.97 2.211 . . . . 0.0 116.97 -174.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.46 114.38 1.99 Allowed 'General case' 0 CA--C 1.572 1.826 0 O-C-N 120.474 -1.391 . . . . 0.0 114.306 -179.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 80.83 15.61 77.17 Favored Glycine 0 N--CA 1.493 2.489 0 N-CA-C 119.43 2.532 . . . . 0.0 119.43 -174.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 tt -132.75 132.46 42.31 Favored 'General case' 0 CA--C 1.568 1.641 0 CA-C-N 119.024 1.412 . . . . 0.0 108.267 -174.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.07 158.06 15.77 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -173.367 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 16.0 t -94.54 111.56 23.32 Favored 'General case' 0 CA--C 1.568 1.671 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.907 172.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 . . . . . 0 CA--C 1.567 1.619 0 O-C-N 120.452 -1.405 . . . . 0.0 110.818 -175.41 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 . . . . . 0 CA--C 1.574 1.902 0 CA-C-O 122.628 1.204 . . . . 0.0 112.82 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -102.41 169.58 19.65 Favored Glycine 0 N--CA 1.489 2.213 0 O-C-N 120.705 -1.247 . . . . 0.0 115.373 174.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 35.5 mm -110.54 135.46 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 173.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.611 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 23.1 m -63.2 131.1 47.3 Favored 'General case' 0 CA--C 1.57 1.748 0 O-C-N 120.528 -1.357 . . . . 0.0 114.352 173.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 -144.6 148.27 34.15 Favored 'General case' 0 CA--C 1.563 1.48 0 O-C-N 120.731 -1.23 . . . . 0.0 109.718 173.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -96.87 130.18 44.2 Favored 'General case' 0 CA--C 1.565 1.55 0 O-C-N 120.692 -1.255 . . . . 0.0 109.835 176.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 61.8 t . . . . . 0 N--CA 1.501 2.084 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.098 -174.212 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 . . . . . 0 N--CA 1.498 1.957 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -138.08 155.07 49.14 Favored 'General case' 0 CA--C 1.574 1.873 0 CA-C-O 122.401 1.096 . . . . 0.0 110.074 172.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -78.11 164.09 25.3 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 119.376 -2.077 . . . . 0.0 114.732 -173.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -73.91 150.18 41.01 Favored 'General case' 0 CA--C 1.573 1.854 0 CA-C-O 122.239 1.019 . . . . 0.0 110.606 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.59 24.76 34.96 Favored Glycine 0 CA--C 1.562 3.027 0 O-C-N 121.484 -0.76 . . . . 0.0 114.819 -170.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -132.95 143.57 49.55 Favored 'General case' 0 CA--C 1.569 1.699 0 C-N-CA 125.632 1.573 . . . . 0.0 108.763 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 34.9 mt -70.92 134.19 47.04 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -174.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.7 p -140.48 152.68 45.81 Favored 'General case' 0 CA--C 1.561 1.373 0 C-N-CA 124.002 0.921 . . . . 0.0 113.124 -174.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -85.4 -77.88 0.28 Allowed 'General case' 0 CA--C 1.567 1.616 0 CA-C-O 117.743 -1.122 . . . . 0.0 108.222 172.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -96.35 170.75 9.02 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 121.149 1.795 . . . . 0.0 114.114 174.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.8 m -69.4 -10.69 59.07 Favored 'General case' 0 N--CA 1.508 2.451 0 N-CA-C 117.077 2.251 . . . . 0.0 117.077 174.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.41 52.82 2.56 Favored 'General case' 0 CA--C 1.571 1.764 0 CA-C-O 123.554 1.645 . . . . 0.0 114.939 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -141.32 -49.59 0.41 Allowed 'General case' 0 CA--C 1.574 1.878 0 CA-C-N 113.968 -1.469 . . . . 0.0 113.98 -177.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 67.4 m -84.19 160.92 20.73 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 116.15 1.907 . . . . 0.0 116.15 -174.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -60.53 -54.24 47.79 Favored 'General case' 0 N--CA 1.504 2.232 0 C-N-CA 124.754 1.222 . . . . 0.0 109.112 171.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.8 t -82.64 92.25 7.12 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 102.07 -3.307 . . . . 0.0 102.07 167.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -72.75 69.19 0.9 Allowed 'General case' 0 N--CA 1.497 1.922 0 CA-C-O 124.64 2.162 . . . . 0.0 116.435 -170.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 43.9 t -145.44 96.39 2.82 Favored 'General case' 0 CA--C 1.557 1.225 0 CA-C-N 112.643 -2.071 . . . . 0.0 110.155 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 15.6 t -78.08 115.08 17.55 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 103.802 -2.666 . . . . 0.0 103.802 171.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -98.84 123.7 43.26 Favored 'General case' 0 CA--C 1.566 1.56 0 CA-C-O 123.156 1.455 . . . . 0.0 114.538 -170.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.55 ' HB2' HG12 ' A' ' 57' ' ' VAL . 12.2 t-80 -87.23 116.77 25.54 Favored 'General case' 0 CA--C 1.562 1.418 0 CA-C-N 114.026 -1.443 . . . . 0.0 113.603 -174.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -83.42 56.35 3.54 Favored 'General case' 0 CA--C 1.581 2.143 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 174.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 17.7 p 77.18 109.73 0.07 Allowed 'General case' 0 N--CA 1.505 2.308 0 N-CA-C 119.454 3.131 . . . . 0.0 119.454 171.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.302 4.7 mp 53.52 -87.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 C-N-CA 126.79 2.036 . . . . 0.0 115.766 172.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.7 tp -103.37 88.1 3.03 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 175.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 54.4 p -136.2 150.5 49.04 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 116.303 1.964 . . . . 0.0 116.303 -172.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 46.2 tp -80.37 117.09 20.81 Favored 'General case' 0 CA--C 1.569 1.709 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 173.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.9 m -92.6 137.2 32.57 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 122.964 1.364 . . . . 0.0 114.515 -171.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.8 ttt180 -134.53 137.35 43.76 Favored 'General case' 0 N--CA 1.495 1.8 0 C-N-CA 124.055 0.942 . . . . 0.0 110.181 -174.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 67.1 m -65.98 148.23 52.12 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 119.606 -1.934 . . . . 0.0 114.946 -177.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.67 -179.47 5.94 Favored 'General case' 0 CA--C 1.57 1.74 0 CA-C-N 113.488 -1.687 . . . . 0.0 112.83 -174.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.2 mt -81.65 138.91 35.24 Favored 'General case' 0 CA--C 1.566 1.579 0 O-C-N 121.069 -1.02 . . . . 0.0 112.932 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.9 pttt -70.67 134.5 47.58 Favored 'General case' 0 CA--C 1.573 1.852 0 O-C-N 121.606 -0.684 . . . . 0.0 110.3 173.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.41 154.73 38.66 Favored 'General case' 0 CA--C 1.561 1.389 0 N-CA-C 118.37 2.73 . . . . 0.0 118.37 -171.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -113.09 171.73 7.37 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 112.569 -2.105 . . . . 0.0 112.722 -177.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -58.94 125.01 21.79 Favored 'General case' 0 CA--C 1.568 1.669 0 CA-C-N 114.838 -1.073 . . . . 0.0 113.009 -174.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 85.51 18.22 0.12 Allowed 'General case' 0 CA--C 1.586 2.338 0 C-N-CA 125.956 1.702 . . . . 0.0 114.177 -173.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.3 t -119.77 151.79 38.24 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 119.953 -1.717 . . . . 0.0 112.312 175.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -74.51 120.71 20.44 Favored 'General case' 0 CA--C 1.575 1.918 0 CA-C-O 123.755 1.74 . . . . 0.0 112.534 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.495 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 19.3 p -122.86 152.53 40.66 Favored 'General case' 0 CA--C 1.562 1.426 0 C-N-CA 127.146 2.178 . . . . 0.0 112.482 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 65.9 m -75.57 123.4 25.43 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.403 -1.436 . . . . 0.0 107.804 173.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.82 -49.33 25.73 Favored 'General case' 0 CA--C 1.565 1.525 0 N-CA-C 116.884 2.179 . . . . 0.0 116.884 -172.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -91.97 151.84 20.31 Favored 'General case' 0 CA--C 1.566 1.591 0 CA-C-N 118.758 0.708 . . . . 0.0 109.867 173.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.6 p -121.0 146.58 46.54 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 124.411 2.053 . . . . 0.0 110.588 174.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -98.47 -126.29 0.16 Allowed 'General case' 0 CA--C 1.569 1.711 0 CA-C-N 112.469 -2.15 . . . . 0.0 105.884 174.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -149.17 70.83 1.1 Allowed 'General case' 0 CA--C 1.564 1.511 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 169.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 175.47 -135.78 3.14 Favored Glycine 0 N--CA 1.483 1.819 0 CA-C-N 115.644 -0.707 . . . . 0.0 113.999 -176.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.55 HG12 ' HB2' ' A' ' 30' ' ' HIS . 3.4 t -79.76 144.22 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.175 0 CA-C-O 122.25 1.024 . . . . 0.0 112.196 -172.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -123.6 135.84 54.18 Favored 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 123.515 0.726 . . . . 0.0 112.56 -173.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -60.42 -51.08 71.02 Favored 'General case' 0 N--CA 1.503 2.218 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 177.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -135.41 122.02 20.79 Favored 'General case' 0 CA--C 1.559 1.311 0 N-CA-C 103.892 -2.633 . . . . 0.0 103.892 174.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 97.2 m -43.91 130.66 4.2 Favored Pre-proline 0 CA--C 1.592 2.588 0 N-CA-C 117.852 2.538 . . . . 0.0 117.852 -174.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -77.65 60.75 7.28 Favored 'Trans proline' 0 CA--C 1.576 2.614 0 C-N-CA 123.179 2.586 . . . . 0.0 118.637 -173.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 37.8 m 61.7 163.92 0.08 Allowed 'General case' 0 CA--C 1.582 2.198 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.42 174.07 11.83 Favored 'General case' 0 CA--C 1.575 1.94 0 N-CA-C 115.19 1.552 . . . . 0.0 115.19 178.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.99 108.65 1.26 Allowed 'General case' 0 CA--C 1.574 1.868 0 O-C-N 120.476 -1.39 . . . . 0.0 112.469 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 93.18 27.7 13.07 Favored Glycine 0 N--CA 1.497 2.709 0 N-CA-C 118.036 1.974 . . . . 0.0 118.036 -173.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 12.3 tp -140.9 138.42 33.87 Favored 'General case' 0 CA--C 1.567 1.614 0 CA-C-N 118.794 1.297 . . . . 0.0 110.225 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -98.74 154.1 18.23 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.708 -1.245 . . . . 0.0 112.828 -176.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.2 t -94.77 146.62 24.06 Favored 'General case' 0 CA--C 1.575 1.911 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.943 172.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 . . . . . 0 N--CA 1.5 2.045 0 O-C-N 120.381 -1.449 . . . . 0.0 110.378 178.45 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 . . . . . 0 CA--C 1.574 1.902 0 CA-C-O 122.27 1.033 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.22 162.33 23.85 Favored Glycine 0 N--CA 1.495 2.576 0 N-CA-C 119.116 2.406 . . . . 0.0 119.116 -174.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 23.2 mm -95.96 136.76 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 O-C-N 120.975 -1.309 . . . . 0.0 110.774 -171.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.495 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 53.2 m -67.85 124.22 22.72 Favored 'General case' 0 CA--C 1.569 1.691 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 174.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -144.12 159.79 42.04 Favored 'General case' 0 CA--C 1.565 1.525 0 CA-C-O 123.328 1.537 . . . . 0.0 111.642 174.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -99.44 132.64 44.63 Favored 'General case' 0 CA--C 1.564 1.512 0 O-C-N 120.855 -1.153 . . . . 0.0 110.7 175.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 59.9 t . . . . . 0 CA--C 1.588 2.43 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -179.372 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.58 2.128 0 N-CA-C 118.017 2.599 . . . . 0.0 118.017 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 mt -131.54 146.48 52.24 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 123.568 1.651 . . . . 0.0 113.838 175.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -80.51 162.6 24.27 Favored 'General case' 0 CA--C 1.567 1.616 0 CA-C-N 114.193 -1.367 . . . . 0.0 113.47 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -76.72 131.78 38.95 Favored 'General case' 0 CA--C 1.578 2.041 0 N-CA-C 107.788 -1.189 . . . . 0.0 107.788 173.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 101.66 26.7 7.48 Favored Glycine 0 CA--C 1.561 2.948 0 CA-C-N 115.766 -0.652 . . . . 0.0 114.469 -171.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -129.24 139.46 51.83 Favored 'General case' 0 CA--C 1.566 1.574 0 C-N-CA 125.121 1.368 . . . . 0.0 109.243 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.0 mp -68.08 124.96 24.86 Favored 'General case' 0 CA--C 1.574 1.868 0 O-C-N 121.152 -0.967 . . . . 0.0 112.191 -178.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 6.8 p -131.39 152.1 50.94 Favored 'General case' 0 CA--C 1.561 1.399 0 C-N-CA 124.229 1.011 . . . . 0.0 113.072 -174.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 97.7 mt -84.09 -74.97 0.36 Allowed 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 118.092 -0.956 . . . . 0.0 108.917 174.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -98.57 172.93 7.18 Favored 'General case' 0 N--CA 1.501 2.09 0 CA-C-N 120.998 1.726 . . . . 0.0 113.331 173.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.9 m -71.92 -9.67 58.68 Favored 'General case' 0 N--CA 1.508 2.463 0 N-CA-C 116.639 2.089 . . . . 0.0 116.639 173.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.72 4.2 12.18 Favored 'General case' 0 CA--C 1.572 1.816 0 N-CA-C 118.27 2.693 . . . . 0.0 118.27 176.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -97.77 -35.59 10.49 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 115.346 1.609 . . . . 0.0 115.346 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 71.4 m -81.05 155.77 26.17 Favored 'General case' 0 CA--C 1.564 1.498 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 177.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -62.96 -50.9 68.98 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.385 -0.822 . . . . 0.0 110.089 172.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.0 p -82.46 97.39 8.38 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 102.851 -3.018 . . . . 0.0 102.851 167.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -70.85 80.55 0.63 Allowed 'General case' 0 N--CA 1.498 1.94 0 CA-C-O 124.6 2.143 . . . . 0.0 115.354 -171.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 41.0 t -158.28 93.12 1.2 Allowed 'General case' 0 CA--C 1.557 1.218 0 CA-C-N 112.248 -2.251 . . . . 0.0 110.699 -176.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.8 t -80.22 113.98 18.79 Favored 'General case' 0 CA--C 1.56 1.348 0 N-CA-C 104.933 -2.247 . . . . 0.0 104.933 171.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 46.7 tp60 -91.99 115.79 28.37 Favored 'General case' 0 CA--C 1.558 1.287 0 CA-C-O 122.347 1.07 . . . . 0.0 113.884 -172.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.515 ' HB2' HG12 ' A' ' 57' ' ' VAL . 24.3 t-80 -81.1 117.28 21.54 Favored 'General case' 0 CA--C 1.562 1.432 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.734 176.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -72.15 56.83 0.34 Allowed 'General case' 0 CA--C 1.581 2.163 0 N-CA-C 116.923 2.194 . . . . 0.0 116.923 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 44.3 p 61.25 69.13 0.68 Allowed 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 126.037 1.735 . . . . 0.0 115.071 173.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.331 3.7 mp 71.1 -32.84 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.534 0 C-N-CA 125.191 1.396 . . . . 0.0 113.762 -179.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.1 tp -53.07 -20.95 4.06 Favored 'General case' 0 CA--C 1.586 2.364 0 N-CA-C 117.627 2.454 . . . . 0.0 117.627 174.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.288 26.3 p 77.93 1.44 2.83 Favored 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 121.692 3.96 . . . . 0.0 121.692 172.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.5 tp -73.64 96.25 2.45 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 121.711 2.05 . . . . 0.0 106.76 172.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.9 m -97.68 107.37 19.85 Favored 'General case' 0 CA--C 1.56 1.344 0 CA-C-O 123.139 1.447 . . . . 0.0 111.648 -171.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -131.22 132.83 44.93 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-N 114.546 -1.206 . . . . 0.0 108.98 -174.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 99.5 m -62.42 150.56 39.53 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 122.402 2.365 . . . . 0.0 116.504 -174.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -132.61 173.41 11.36 Favored 'General case' 0 CA--C 1.568 1.658 0 CA-C-N 114.162 -1.381 . . . . 0.0 113.842 -174.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 26.6 tp -85.47 146.19 27.07 Favored 'General case' 0 CA--C 1.569 1.677 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -174.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -69.95 143.32 52.7 Favored 'General case' 0 CA--C 1.577 2.001 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 175.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.492 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . . . -78.93 169.61 17.96 Favored 'General case' 0 CA--C 1.579 2.077 0 N-CA-C 118.272 2.694 . . . . 0.0 118.272 -173.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 46.3 mtp180 -112.66 173.87 6.17 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 113.19 -1.823 . . . . 0.0 112.57 -178.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -64.2 136.76 57.51 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 122.083 0.944 . . . . 0.0 113.134 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 70.98 23.31 4.29 Favored 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 124.93 1.292 . . . . 0.0 114.118 -173.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.9 t -121.87 148.54 44.59 Favored 'General case' 0 CA--C 1.558 1.266 0 CA-C-O 122.596 1.189 . . . . 0.0 110.263 174.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -67.53 133.49 49.56 Favored 'General case' 0 CA--C 1.576 1.953 0 CA-C-O 123.749 1.738 . . . . 0.0 112.137 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 87' ' ' CYS . 22.3 p -137.41 156.43 48.2 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 112.855 -1.975 . . . . 0.0 112.552 -174.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 92.9 p -81.64 117.57 22.1 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 172.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.36 -55.31 7.3 Favored 'General case' 0 CA--C 1.583 2.244 0 CA-C-O 122.813 1.292 . . . . 0.0 108.181 172.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -155.24 127.64 7.82 Favored 'General case' 0 CA--C 1.573 1.838 0 N-CA-C 101.795 -3.409 . . . . 0.0 101.795 169.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.4 m -88.39 -70.43 0.64 Allowed 'General case' 0 CA--C 1.568 1.651 0 O-C-N 119.434 -2.042 . . . . 0.0 106.125 171.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -152.59 -72.67 0.14 Allowed 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 124.694 1.198 . . . . 0.0 109.816 173.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -162.43 -43.45 0.04 OUTLIER 'General case' 0 CA--C 1.579 2.084 0 C-N-CA 125.128 1.371 . . . . 0.0 113.851 -173.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -96.95 -120.44 3.94 Favored Glycine 0 N--CA 1.485 1.942 0 N-CA-C 116.94 1.536 . . . . 0.0 116.94 -172.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.515 HG12 ' HB2' ' A' ' 30' ' ' HIS . 3.1 t -82.16 141.04 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 CA-C-O 122.415 1.102 . . . . 0.0 111.11 -175.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 17.0 m-30 -122.65 148.84 44.79 Favored 'General case' 0 CA--C 1.559 1.317 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 -171.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -77.97 -9.05 58.91 Favored 'General case' 0 CA--C 1.585 2.311 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 173.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.61 140.04 9.45 Favored 'General case' 0 CA--C 1.571 1.752 0 C-N-CA 126.68 1.992 . . . . 0.0 106.686 -174.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 96.3 m -82.64 156.26 68.13 Favored Pre-proline 0 CA--C 1.581 2.135 0 N-CA-C 116.706 2.113 . . . . 0.0 116.706 177.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.51 171.52 16.96 Favored 'Trans proline' 0 CA--C 1.571 2.361 0 C-N-CA 122.704 2.269 . . . . 0.0 112.989 173.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.492 ' SG ' ' HB3' ' A' ' 43' ' ' ALA . 5.3 m -85.85 170.07 12.74 Favored 'General case' 0 CA--C 1.568 1.666 0 CA-C-O 123.751 1.739 . . . . 0.0 115.042 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -59.73 154.68 17.53 Favored 'General case' 0 CA--C 1.572 1.824 0 N-CA-C 115.805 1.78 . . . . 0.0 115.805 178.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -65.62 113.37 4.18 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 122.62 1.2 . . . . 0.0 112.427 -174.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 115.43 -27.08 8.66 Favored Glycine 0 N--CA 1.497 2.756 0 CA-C-N 114.099 -1.41 . . . . 0.0 116.355 -172.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 11.7 tp -97.42 138.81 34.29 Favored 'General case' 0 CA--C 1.569 1.688 0 CA-C-N 118.504 1.152 . . . . 0.0 110.936 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -97.19 148.82 22.69 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.424 -1.423 . . . . 0.0 113.443 -174.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 16.7 t -94.37 100.82 12.78 Favored 'General case' 0 CA--C 1.569 1.681 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.094 173.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 . . . . . 0 N--CA 1.497 1.917 0 CA-C-N 120.587 1.54 . . . . 0.0 111.66 -176.767 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 123.079 1.418 . . . . 0.0 110.159 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -166.18 154.73 25.5 Favored Glycine 0 N--CA 1.488 2.165 0 O-C-N 121.075 -1.016 . . . . 0.0 112.936 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.7 mm -94.19 138.43 20.59 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.161 0 CA-C-N 119.44 1.62 . . . . 0.0 109.188 -176.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 61.2 m -74.73 123.41 24.88 Favored 'General case' 0 CA--C 1.563 1.461 0 N-CA-C 116.177 1.917 . . . . 0.0 116.177 178.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -141.11 158.62 43.66 Favored 'General case' 0 CA--C 1.561 1.373 0 CA-C-O 123.488 1.614 . . . . 0.0 111.483 179.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -98.15 40.7 1.16 Allowed 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 174.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.0 t . . . . . 0 N--CA 1.502 2.14 0 C-N-CA 127.012 2.125 . . . . 0.0 113.811 174.897 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 55.7 m-80 . . . . . 0 CA--C 1.573 1.853 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mp -131.0 136.44 48.51 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.21 -1.557 . . . . 0.0 112.226 174.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -84.97 172.41 11.35 Favored 'General case' 0 CA--C 1.572 1.814 0 O-C-N 121.365 -0.835 . . . . 0.0 112.887 174.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -77.01 114.54 15.92 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 173.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 135.25 -8.97 4.41 Favored Glycine 0 CA--C 1.56 2.883 0 CA-C-N 114.298 -1.319 . . . . 0.0 115.627 -172.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -114.76 154.65 28.14 Favored 'General case' 0 CA--C 1.569 1.675 0 CA-C-N 120.084 1.942 . . . . 0.0 112.162 -177.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -81.83 147.95 29.1 Favored 'General case' 0 CA--C 1.574 1.866 0 CA-C-O 122.114 0.959 . . . . 0.0 113.303 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.6 p -137.55 -179.03 5.5 Favored 'General case' 0 CA--C 1.575 1.906 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -174.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.6 tp -99.29 -74.14 0.6 Allowed 'General case' 0 CA--C 1.58 2.121 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 171.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -94.87 -173.15 2.9 Favored 'General case' 0 N--CA 1.501 2.12 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 174.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.8 m -78.05 -31.93 50.59 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 119.79 -1.819 . . . . 0.0 114.703 172.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.83 65.43 4.99 Favored 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 124.706 2.193 . . . . 0.0 111.608 173.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -139.96 -50.17 0.48 Allowed 'General case' 0 CA--C 1.566 1.584 0 CA-C-N 111.89 -2.414 . . . . 0.0 111.258 -174.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 95.4 m -81.27 140.8 34.64 Favored 'General case' 0 CA--C 1.564 1.518 0 O-C-N 121.162 -0.961 . . . . 0.0 109.997 173.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -53.35 -30.3 38.69 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 118.694 2.85 . . . . 0.0 118.694 -173.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -79.78 -76.68 0.21 Allowed 'General case' 0 CA--C 1.574 1.879 0 CA-C-N 118.219 0.463 . . . . 0.0 110.516 173.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -173.07 -39.67 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.35 0 N-CA-C 116.565 2.061 . . . . 0.0 116.565 -176.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.3 t -97.71 110.52 23.07 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 119.711 3.226 . . . . 0.0 119.711 -169.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 22.5 t -95.41 118.87 32.93 Favored 'General case' 0 CA--C 1.562 1.409 0 N-CA-C 104.436 -2.431 . . . . 0.0 104.436 168.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.99 114.28 27.45 Favored 'General case' 0 CA--C 1.57 1.731 0 CA-C-O 123.185 1.469 . . . . 0.0 114.672 -172.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.697 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.1 t60 -82.52 155.54 24.49 Favored 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 126.432 1.893 . . . . 0.0 112.348 177.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.2 p30 -81.88 40.15 0.59 Allowed 'General case' 0 CA--C 1.587 2.396 0 O-C-N 120.434 -1.416 . . . . 0.0 114.21 172.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 48.7 p 63.54 90.02 0.08 Allowed 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 126.429 1.892 . . . . 0.0 113.68 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.301 3.2 mp 69.31 -38.04 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 174.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.3 mt -71.09 -87.41 0.02 OUTLIER 'General case' 0 CA--C 1.576 1.956 0 CA-C-N 122.405 2.366 . . . . 0.0 112.228 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 91.9 p -155.67 -131.25 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.022 0 CA-C-N 122.029 2.195 . . . . 0.0 114.005 174.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 20.7 tp 43.76 75.83 0.09 Allowed 'General case' 0 N--CA 1.502 2.125 0 C-N-CA 125.911 1.684 . . . . 0.0 115.113 -174.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.671 ' HB3' HG11 ' A' ' 57' ' ' VAL . 18.7 m -98.81 86.61 3.55 Favored 'General case' 0 CA--C 1.565 1.531 0 CA-C-O 122.205 1.002 . . . . 0.0 110.69 -174.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -120.36 127.66 52.52 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.653 1.181 . . . . 0.0 109.977 -174.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 74.8 m -66.6 140.42 57.94 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 116.281 1.956 . . . . 0.0 116.281 -174.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -142.34 173.17 11.77 Favored 'General case' 0 CA--C 1.565 1.554 0 CA-C-N 113.312 -1.767 . . . . 0.0 114.314 -173.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.6 pp -84.9 165.52 17.6 Favored 'General case' 0 CA--C 1.573 1.831 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 178.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -74.35 146.69 42.84 Favored 'General case' 0 CA--C 1.574 1.877 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.41 164.04 25.84 Favored 'General case' 0 CA--C 1.571 1.761 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -174.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 65.3 mtt180 -128.87 165.28 21.34 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 122.556 1.17 . . . . 0.0 112.338 -175.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -43.09 126.77 4.08 Favored 'General case' 0 CA--C 1.568 1.656 0 N-CA-C 117.3 2.333 . . . . 0.0 117.3 -172.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 72.39 17.97 4.66 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 115.248 1.573 . . . . 0.0 115.248 -174.09 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.7 t -117.75 150.32 39.3 Favored 'General case' 0 CA--C 1.565 1.533 0 CA-C-O 122.758 1.266 . . . . 0.0 110.619 174.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -65.33 122.0 16.12 Favored 'General case' 0 CA--C 1.573 1.85 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 -175.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.422 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 4.6 t -113.03 137.34 51.56 Favored 'General case' 0 CA--C 1.558 1.275 0 CA-C-N 113.489 -1.687 . . . . 0.0 111.232 174.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.1 t -99.68 115.68 30.03 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 172.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.19 -22.33 45.11 Favored 'General case' 0 CA--C 1.572 1.789 0 N-CA-C 115.997 1.851 . . . . 0.0 115.997 -178.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -129.33 154.64 46.68 Favored 'General case' 0 CA--C 1.578 2.027 0 N-CA-C 117.431 2.382 . . . . 0.0 117.431 -176.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.6 t 131.47 -152.51 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.523 2 N-CA-C 97.042 -5.17 . . . . 0.0 97.042 -171.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.653 3.6 mt 176.02 -69.36 0.01 OUTLIER 'General case' 0 N--CA 1.521 3.075 1 O-C-N 113.353 -5.842 . . . . 0.0 110.608 160.858 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -78.8 -26.81 44.35 Favored 'General case' 0 CA--C 1.577 1.997 0 CA-C-N 112.433 -2.167 . . . . 0.0 108.883 168.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -81.97 159.76 40.05 Favored Glycine 0 CA--C 1.55 2.219 0 N-CA-C 107.619 -2.193 . . . . 0.0 107.619 170.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.697 HG12 ' HB2' ' A' ' 30' ' ' HIS . 93.6 t -70.87 135.67 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 CA-C-O 123.715 1.721 . . . . 0.0 112.028 -163.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 -66.7 124.23 22.3 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 113.014 -1.903 . . . . 0.0 114.779 -172.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -69.3 -40.63 77.57 Favored 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 114.787 1.402 . . . . 0.0 114.787 -174.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -149.95 103.84 3.24 Favored 'General case' 0 CA--C 1.569 1.684 0 N-CA-C 101.593 -3.484 . . . . 0.0 101.593 172.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 57.2 m -39.91 127.61 1.58 Allowed Pre-proline 0 CA--C 1.587 2.396 0 N-CA-C 116.913 2.19 . . . . 0.0 116.913 -173.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -47.83 166.33 0.12 Allowed 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 123.52 2.813 . . . . 0.0 119.266 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 58.4 m -68.01 146.09 53.86 Favored 'General case' 0 CA--C 1.569 1.686 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -178.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -178.72 1.42 Allowed 'General case' 0 CA--C 1.577 2.011 0 N-CA-C 115.268 1.581 . . . . 0.0 115.268 -176.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -60.84 112.45 2.05 Favored 'General case' 0 CA--C 1.571 1.76 0 O-C-N 120.349 -1.469 . . . . 0.0 113.096 -175.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.13 -20.65 35.17 Favored Glycine 0 N--CA 1.496 2.699 0 N-CA-C 118.629 2.212 . . . . 0.0 118.629 -173.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.1 mp -106.35 151.93 24.23 Favored 'General case' 0 CA--C 1.569 1.689 0 CA-C-N 118.841 1.32 . . . . 0.0 112.183 -178.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.96 158.26 17.87 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-O 122.368 1.08 . . . . 0.0 113.611 -176.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 6.1 t -90.71 120.04 31.43 Favored 'General case' 0 CA--C 1.57 1.745 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.526 173.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.582 2.193 0 CA-C-N 120.23 1.377 . . . . 0.0 111.775 -174.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.3 m-30 . . . . . 0 CA--C 1.57 1.716 0 CA-C-O 123.094 1.426 . . . . 0.0 110.541 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -139.39 -155.68 6.71 Favored Glycine 0 N--CA 1.48 1.575 0 O-C-N 120.909 -1.119 . . . . 0.0 114.555 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.9 mm -128.97 142.64 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.422 ' SG ' ' HB2' ' A' ' 49' ' ' CYS . 35.7 m -70.86 129.45 39.09 Favored 'General case' 0 CA--C 1.564 1.491 0 O-C-N 120.561 -1.337 . . . . 0.0 113.017 173.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 63.6 m-70 -140.46 155.81 46.57 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 123.203 1.478 . . . . 0.0 111.38 176.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -95.33 128.52 42.24 Favored 'General case' 0 CA--C 1.562 1.429 0 CA-C-O 122.367 1.079 . . . . 0.0 110.607 -176.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 9.9 m . . . . . 0 CA--C 1.579 2.072 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -174.792 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.375 0.0 OUTLIER . . . . . 0 CA--C 1.584 2.254 0 CA-C-O 122.628 1.204 . . . . 0.0 111.944 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.86 158.97 38.74 Favored 'General case' 0 CA--C 1.573 1.858 0 CA-C-O 122.989 1.376 . . . . 0.0 111.786 173.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -80.47 165.33 22.28 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.097 -1.627 . . . . 0.0 114.456 -174.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.89 123.69 26.1 Favored 'General case' 0 CA--C 1.574 1.887 0 O-C-N 121.44 -0.787 . . . . 0.0 111.036 -179.217 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 129.0 2.37 5.62 Favored Glycine 0 CA--C 1.557 2.677 0 N-CA-C 117.371 1.708 . . . . 0.0 117.371 -173.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -121.71 155.49 35.1 Favored 'General case' 0 CA--C 1.572 1.801 0 CA-C-N 119.895 1.847 . . . . 0.0 112.0 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.4 tt -71.19 137.64 48.89 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -174.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -125.59 176.43 6.87 Favored 'General case' 0 CA--C 1.571 1.78 0 N-CA-C 115.459 1.651 . . . . 0.0 115.459 -174.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.4 mp -110.11 -75.85 0.62 Allowed 'General case' 0 CA--C 1.577 1.993 0 N-CA-C 104.463 -2.421 . . . . 0.0 104.463 169.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -96.19 -178.65 4.39 Favored 'General case' 0 CA--C 1.584 2.264 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 172.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.8 m -86.82 -19.49 28.91 Favored 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 116.617 2.081 . . . . 0.0 116.617 174.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.33 13.91 1.07 Allowed 'General case' 0 CA--C 1.578 2.051 0 N-CA-C 117.539 2.422 . . . . 0.0 117.539 174.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -95.22 -27.25 15.61 Favored 'General case' 0 CA--C 1.568 1.641 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.2 m -80.44 166.72 20.97 Favored 'General case' 0 CA--C 1.58 2.113 0 CA-C-N 120.875 1.671 . . . . 0.0 113.803 177.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.9 mtpp -67.65 -59.77 3.07 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.432 -1.417 . . . . 0.0 108.358 172.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.2 p -82.74 100.13 10.08 Favored 'General case' 0 CA--C 1.57 1.718 0 N-CA-C 102.891 -3.003 . . . . 0.0 102.891 168.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -68.5 79.72 0.27 Allowed 'General case' 0 N--CA 1.498 1.972 0 CA-C-O 125.232 2.444 . . . . 0.0 116.233 -171.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 t -146.23 95.88 2.69 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-N 111.646 -2.525 . . . . 0.0 110.188 -174.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.3 t -93.95 123.75 37.52 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 107.138 -1.431 . . . . 0.0 107.138 171.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.539 HE21 ' H ' ' A' ' 30' ' ' HIS . 29.1 tp60 -76.35 149.16 37.04 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 122.784 1.278 . . . . 0.0 110.427 174.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.539 ' H ' HE21 ' A' ' 29' ' ' GLN . 0.3 OUTLIER -61.24 155.5 20.83 Favored 'General case' 0 CA--C 1.574 1.873 1 N-CA-C 129.105 6.706 . . . . 0.0 129.105 -170.664 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -100.71 -34.34 9.89 Favored 'General case' 0 CA--C 1.578 2.024 0 CA-C-N 110.215 -3.175 . . . . 0.0 119.367 173.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.422 ' H ' ' CE1' ' A' ' 30' ' ' HIS . 0.3 OUTLIER -89.19 -55.43 3.68 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.415 -1.428 . . . . 0.0 113.79 -172.488 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 9.2 pt -76.81 -52.68 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.265 0 CA-C-N 120.48 1.491 . . . . 0.0 110.893 173.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.3 tt -95.88 118.72 33.06 Favored 'General case' 0 CA--C 1.565 1.555 0 N-CA-C 103.544 -2.762 . . . . 0.0 103.544 171.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.4 p -91.21 61.74 4.58 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 118.726 2.861 . . . . 0.0 118.726 -172.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.7 tp -173.72 110.48 0.17 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 174.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.2 m -91.11 122.05 33.42 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 121.026 1.739 . . . . 0.0 111.72 -174.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -136.48 147.38 47.13 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-N 114.31 -1.314 . . . . 0.0 111.55 -172.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 89.4 m -65.49 135.58 55.34 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 118.278 -2.764 . . . . 0.0 111.357 174.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -134.02 -176.7 4.27 Favored 'General case' 0 CA--C 1.566 1.575 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -173.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -91.51 162.02 14.72 Favored 'General case' 0 CA--C 1.573 1.857 0 CA-C-O 122.524 1.155 . . . . 0.0 113.745 177.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -81.83 153.07 26.61 Favored 'General case' 0 CA--C 1.572 1.816 0 CA-C-O 121.529 0.681 . . . . 0.0 112.354 174.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.49 158.84 28.5 Favored 'General case' 0 CA--C 1.567 1.631 0 N-CA-C 115.332 1.604 . . . . 0.0 115.332 -176.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -118.21 174.2 6.36 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 114.383 -1.28 . . . . 0.0 111.897 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -48.96 133.96 17.48 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 116.795 2.146 . . . . 0.0 116.795 -172.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.9 m120 71.57 15.47 6.06 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 -174.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.1 t -113.7 152.61 30.23 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 120.778 -1.201 . . . . 0.0 111.766 174.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -64.72 136.9 57.44 Favored 'General case' 0 CA--C 1.568 1.64 0 CA-C-O 123.313 1.53 . . . . 0.0 112.777 174.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.434 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 24.6 p -136.26 143.25 44.16 Favored 'General case' 0 CA--C 1.562 1.409 0 CA-C-N 112.911 -1.95 . . . . 0.0 112.241 -177.266 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 72.5 m -77.83 99.53 5.97 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-O 122.098 0.952 . . . . 0.0 108.787 177.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -75.74 -47.14 27.24 Favored 'General case' 0 CA--C 1.567 1.626 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 -173.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -79.17 -40.27 31.3 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 176.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.2 p 58.96 164.18 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.091 0 CA-C-O 124.332 2.015 . . . . 0.0 114.367 -174.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.74 -166.53 1.73 Allowed 'General case' 0 CA--C 1.566 1.561 0 CA-C-O 123.466 1.603 . . . . 0.0 108.916 173.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -96.16 68.37 2.66 Favored 'General case' 0 CA--C 1.576 1.96 0 N-CA-C 104.962 -2.236 . . . . 0.0 104.962 171.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 178.0 -165.75 35.45 Favored Glycine 0 N--CA 1.484 1.887 0 N-CA-C 116.474 1.35 . . . . 0.0 116.474 -173.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 2.8 t -77.89 146.62 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 CA-C-O 122.257 1.027 . . . . 0.0 111.594 -171.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -110.34 137.01 48.64 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -172.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -61.44 -52.54 64.12 Favored 'General case' 0 CA--C 1.579 2.085 0 CA-C-N 114.075 -1.42 . . . . 0.0 111.846 173.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -140.71 109.08 5.83 Favored 'General case' 0 CA--C 1.566 1.578 0 N-CA-C 104.084 -2.562 . . . . 0.0 104.084 173.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 42.8 m -48.94 156.89 0.85 Allowed Pre-proline 0 CA--C 1.587 2.393 0 N-CA-C 118.027 2.602 . . . . 0.0 118.027 -177.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -60.25 170.84 3.64 Favored 'Trans proline' 0 CA--C 1.573 2.43 0 C-N-CA 122.678 2.252 . . . . 0.0 116.179 177.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 62.5 m -73.16 149.72 42.74 Favored 'General case' 0 CA--C 1.571 1.773 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -70.48 171.98 9.21 Favored 'General case' 0 CA--C 1.577 2.003 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 -58.94 112.95 1.85 Allowed 'General case' 0 CA--C 1.576 1.967 0 O-C-N 120.551 -1.343 . . . . 0.0 113.388 -177.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 112.84 -21.9 17.55 Favored Glycine 0 N--CA 1.496 2.659 0 N-CA-C 117.751 1.86 . . . . 0.0 117.751 -173.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.7 mp -111.5 148.75 32.5 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 119.521 1.66 . . . . 0.0 111.718 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.89 153.19 23.88 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 122.22 1.01 . . . . 0.0 113.106 -177.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 7.4 t -95.21 123.95 38.98 Favored 'General case' 0 CA--C 1.569 1.678 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.529 173.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 . . . . . 0 N--CA 1.506 2.371 0 O-C-N 119.936 -1.727 . . . . 0.0 111.404 178.236 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 . . . . . 0 CA--C 1.56 1.354 0 CA-C-O 122.337 1.065 . . . . 0.0 109.894 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -98.22 -178.7 32.94 Favored Glycine 0 N--CA 1.485 1.921 0 N-CA-C 115.456 0.943 . . . . 0.0 115.456 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 32.9 mm -108.9 140.9 25.75 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 171.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.434 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 57.8 m -69.7 124.47 24.05 Favored 'General case' 0 CA--C 1.566 1.561 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 174.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 78.8 m-70 -144.69 155.75 43.74 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 122.805 1.288 . . . . 0.0 112.19 175.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -96.58 139.07 33.2 Favored 'General case' 0 CA--C 1.567 1.603 0 O-C-N 121.096 -1.003 . . . . 0.0 111.208 175.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.499 1.994 0 CA-C-O 122.675 1.226 . . . . 0.0 108.447 -179.749 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.7 p30 . . . . . 0 CA--C 1.58 2.104 0 N-CA-C 117.01 2.226 . . . . 0.0 117.01 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.8 tp -107.16 127.42 53.49 Favored 'General case' 0 CA--C 1.575 1.918 0 O-C-N 118.96 -2.337 . . . . 0.0 112.502 -175.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -81.03 172.13 14.11 Favored 'General case' 0 CA--C 1.575 1.922 0 O-C-N 119.702 -1.874 . . . . 0.0 114.522 179.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -67.37 143.7 56.2 Favored 'General case' 0 CA--C 1.569 1.674 0 C-N-CA 123.973 0.909 . . . . 0.0 112.006 176.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 98.33 -1.8 59.02 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 117.352 1.701 . . . . 0.0 117.352 -173.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -112.36 149.26 32.73 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-N 118.943 1.372 . . . . 0.0 111.701 -178.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.4 tp -70.67 130.25 41.27 Favored 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -177.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 22.0 p -132.38 150.58 52.13 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.93 0.892 . . . . 0.0 112.79 -178.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.1 tp -84.29 -78.62 0.23 Allowed 'General case' 0 CA--C 1.57 1.728 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 172.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 -94.71 170.19 9.63 Favored 'General case' 0 CA--C 1.57 1.747 0 CA-C-N 120.012 1.278 . . . . 0.0 113.684 174.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.2 p -69.62 -15.33 63.18 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 171.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.6 40.96 0.31 Allowed 'General case' 0 CA--C 1.575 1.919 0 N-CA-C 116.467 2.025 . . . . 0.0 116.467 174.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -136.15 -40.76 0.66 Allowed 'General case' 0 CA--C 1.573 1.845 0 C-N-CA 125.954 1.702 . . . . 0.0 113.08 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 74.2 m -84.64 152.22 23.95 Favored 'General case' 0 CA--C 1.567 1.605 0 N-CA-C 115.837 1.792 . . . . 0.0 115.837 -178.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -59.92 -55.88 28.65 Favored 'General case' 0 N--CA 1.503 2.209 0 C-N-CA 124.55 1.14 . . . . 0.0 109.896 173.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.6 m -82.27 102.1 10.96 Favored 'General case' 0 CA--C 1.569 1.686 0 N-CA-C 102.58 -3.119 . . . . 0.0 102.58 168.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -71.03 78.26 0.66 Allowed 'General case' 0 CA--C 1.569 1.697 0 CA-C-O 124.095 1.902 . . . . 0.0 114.583 -171.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 47.0 t -152.6 97.78 2.29 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-N 113.338 -1.756 . . . . 0.0 111.538 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 13.5 t -83.82 111.38 19.15 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 104.979 -2.23 . . . . 0.0 104.979 171.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.6 124.63 40.65 Favored 'General case' 0 CA--C 1.557 1.238 0 CA-C-O 122.472 1.129 . . . . 0.0 111.642 -172.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 -80.33 137.58 36.59 Favored 'General case' 0 CA--C 1.568 1.664 0 CA-C-O 122.698 1.237 . . . . 0.0 113.905 -174.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -63.98 -24.91 67.9 Favored 'General case' 0 CA--C 1.58 2.127 0 N-CA-C 117.5 2.407 . . . . 0.0 117.5 173.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.334 40.3 p 124.33 95.97 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 128.991 2.916 . . . . 0.0 108.496 174.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.414 7.5 tp 56.64 -49.11 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 N-CA-C 118.751 2.871 . . . . 0.0 118.751 177.669 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.6 tp -78.87 90.37 4.71 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 122.102 2.228 . . . . 0.0 108.522 173.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.3 p -52.51 103.95 0.08 Allowed 'General case' 0 CA--C 1.575 1.912 1 N-CA-C 122.514 4.265 . . . . 0.0 122.514 -171.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.0 tp -146.3 83.05 1.61 Allowed 'General case' 0 CA--C 1.572 1.799 0 N-CA-C 101.772 -3.418 . . . . 0.0 101.772 171.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.8 m -98.14 144.58 27.46 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -171.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.9 ttp180 -134.09 138.8 45.52 Favored 'General case' 0 CA--C 1.567 1.602 0 C-N-CA 124.372 1.069 . . . . 0.0 110.16 -175.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 65.1 m -68.04 144.87 54.92 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 119.694 -1.879 . . . . 0.0 114.017 177.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.75 172.81 12.18 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-N 113.416 -1.72 . . . . 0.0 114.381 -173.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 33.2 tp -81.71 143.79 31.6 Favored 'General case' 0 CA--C 1.567 1.626 0 CA-C-O 122.411 1.1 . . . . 0.0 113.196 -175.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.1 ptpt -66.2 145.53 55.68 Favored 'General case' 0 CA--C 1.574 1.874 0 CA-C-O 122.033 0.921 . . . . 0.0 113.271 174.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.13 159.75 29.53 Favored 'General case' 0 CA--C 1.569 1.682 0 N-CA-C 117.681 2.474 . . . . 0.0 117.681 -172.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.9 mtt180 -124.65 170.72 10.68 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 112.876 -1.966 . . . . 0.0 111.528 -177.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -45.34 125.87 5.93 Favored 'General case' 0 CA--C 1.571 1.78 0 N-CA-C 116.555 2.057 . . . . 0.0 116.555 -174.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 75.68 18.27 2.21 Favored 'General case' 0 N--CA 1.506 2.353 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -173.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.8 t -110.27 149.15 30.58 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 120.356 -1.465 . . . . 0.0 112.392 175.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -71.76 119.81 16.47 Favored 'General case' 0 CA--C 1.57 1.749 0 C-N-CA 124.799 1.24 . . . . 0.0 111.28 -179.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.436 ' SG ' ' HA ' ' A' ' 62' ' ' PRO . 0.6 OUTLIER -123.87 154.35 39.78 Favored 'General case' 0 CA--C 1.564 1.499 0 CA-C-O 123.305 1.526 . . . . 0.0 114.427 -174.621 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.3 t -93.65 109.55 21.18 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 171.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.0 10.13 3.11 Favored 'General case' 0 CA--C 1.582 2.203 0 N-CA-C 118.325 2.713 . . . . 0.0 118.325 -179.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 44.4 p90 -143.69 160.44 40.7 Favored 'General case' 0 CA--C 1.57 1.718 0 C-N-CA 126.47 1.908 . . . . 0.0 111.076 -173.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.7 p -131.2 136.52 48.34 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 122.675 1.226 . . . . 0.0 109.637 172.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -99.78 -136.74 0.3 Allowed 'General case' 0 CA--C 1.566 1.577 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 173.305 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -128.18 74.12 1.52 Allowed 'General case' 0 CA--C 1.568 1.667 0 N-CA-C 103.414 -2.81 . . . . 0.0 103.414 170.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 161.33 -146.2 11.94 Favored Glycine 0 N--CA 1.488 2.11 0 N-CA-C 117.294 1.678 . . . . 0.0 117.294 -175.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.0 t -91.35 147.18 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 CA-C-O 122.92 1.343 . . . . 0.0 112.52 -166.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -119.86 137.13 54.19 Favored 'General case' 0 CA--C 1.556 1.208 0 CA-C-O 122.349 1.071 . . . . 0.0 110.787 -174.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -76.08 -9.74 58.86 Favored 'General case' 0 CA--C 1.582 2.196 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 174.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 11.3 ptpt -163.91 125.01 2.26 Favored 'General case' 0 CA--C 1.567 1.608 0 N-CA-C 105.965 -1.865 . . . . 0.0 105.965 175.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 64.0 m -62.67 144.01 96.34 Favored Pre-proline 0 CA--C 1.589 2.474 0 N-CA-C 117.123 2.268 . . . . 0.0 117.123 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.436 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 77.5 Cg_exo -56.93 170.44 1.45 Allowed 'Trans proline' 0 CA--C 1.575 2.552 0 C-N-CA 123.067 2.511 . . . . 0.0 117.148 174.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 60.3 m -77.18 163.68 26.34 Favored 'General case' 0 CA--C 1.578 2.045 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -74.63 173.03 11.01 Favored 'General case' 0 CA--C 1.578 2.036 0 N-CA-C 117.351 2.352 . . . . 0.0 117.351 -175.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 53.1 tpt85 -66.94 113.47 4.99 Favored 'General case' 0 CA--C 1.571 1.756 0 O-C-N 120.524 -1.36 . . . . 0.0 111.6 174.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.63 -0.3 59.51 Favored Glycine 0 N--CA 1.499 2.841 0 N-CA-C 118.262 2.065 . . . . 0.0 118.262 -173.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.9 tt -135.79 132.81 37.2 Favored 'General case' 0 CA--C 1.568 1.671 0 CA-C-N 119.401 1.6 . . . . 0.0 107.742 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.32 159.85 14.73 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 116.445 2.017 . . . . 0.0 116.445 -171.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.9 t -93.11 127.62 38.72 Favored 'General case' 0 CA--C 1.57 1.747 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.653 173.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 . . . . . 0 N--CA 1.501 2.086 0 O-C-N 119.813 -1.804 . . . . 0.0 110.329 178.152 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 122.741 1.258 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -142.02 -171.21 12.9 Favored Glycine 0 N--CA 1.48 1.58 0 CA-C-N 115.351 -0.841 . . . . 0.0 115.194 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 32.3 mm -114.4 137.24 48.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 174.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 64.5 m -67.87 125.95 27.9 Favored 'General case' 0 CA--C 1.568 1.637 0 O-C-N 120.903 -1.123 . . . . 0.0 113.349 174.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -143.22 156.97 44.87 Favored 'General case' 0 CA--C 1.561 1.394 0 CA-C-O 123.43 1.585 . . . . 0.0 111.662 175.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -98.23 108.55 21.28 Favored 'General case' 0 CA--C 1.563 1.478 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 174.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.5 2.029 0 CA-C-O 123.579 1.656 . . . . 0.0 111.81 -174.684 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 . . . . . 0 CA--C 1.573 1.848 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 17.8 tp -96.68 96.68 8.79 Favored 'General case' 0 CA--C 1.568 1.636 0 O-C-N 120.15 -1.594 . . . . 0.0 113.442 174.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -98.24 151.68 20.21 Favored 'General case' 0 CA--C 1.578 2.026 0 N-CA-C 106.101 -1.814 . . . . 0.0 106.101 166.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -81.21 102.6 10.44 Favored 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 104.125 -2.546 . . . . 0.0 104.125 171.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 128.57 26.87 0.92 Allowed Glycine 0 CA--C 1.546 2.004 0 CA-C-N 113.547 -1.661 . . . . 0.0 115.669 -172.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -93.35 105.62 17.67 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 119.886 1.843 . . . . 0.0 108.167 172.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 mp -72.56 104.54 3.89 Favored 'General case' 0 N--CA 1.493 1.725 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 175.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 2.5 p -111.47 173.05 6.53 Favored 'General case' 0 CA--C 1.563 1.447 0 N-CA-C 117.888 2.551 . . . . 0.0 117.888 -171.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.1 tp -94.46 -73.71 0.57 Allowed 'General case' 0 CA--C 1.579 2.058 0 N-CA-C 105.965 -1.865 . . . . 0.0 105.965 170.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -100.7 -165.0 1.16 Allowed 'General case' 0 CA--C 1.583 2.249 0 C-N-CA 125.217 1.407 . . . . 0.0 113.707 172.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.1 m -93.61 -0.24 56.25 Favored 'General case' 0 N--CA 1.504 2.237 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 173.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.18 11.16 1.98 Allowed 'General case' 0 CA--C 1.578 2.037 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 174.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -96.2 -33.39 12.04 Favored 'General case' 0 CA--C 1.587 2.389 0 C-N-CA 125.766 1.627 . . . . 0.0 111.598 172.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . 0.305 85.0 m -87.6 131.33 34.45 Favored 'General case' 0 CA--C 1.587 2.388 0 C-N-CA 125.477 1.511 . . . . 0.0 109.674 172.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -41.33 -50.99 3.74 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 121.676 3.954 . . . . 0.0 121.676 -171.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 100.0 p -80.09 -77.33 0.19 Allowed 'General case' 0 CA--C 1.569 1.682 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 174.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -178.11 78.36 0.02 OUTLIER 'General case' 0 CA--C 1.571 1.752 0 N-CA-C 104.147 -2.538 . . . . 0.0 104.147 172.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 40.6 t -142.1 59.8 1.47 Allowed 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 116.203 1.927 . . . . 0.0 116.203 -173.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.525 ' HA ' ' SG ' ' A' ' 39' ' ' CYS . 19.3 t -92.84 119.53 32.27 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 169.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.91 115.73 31.1 Favored 'General case' 0 CA--C 1.569 1.703 0 CA-C-O 123.415 1.579 . . . . 0.0 113.745 -171.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.597 ' HB2' HG12 ' A' ' 57' ' ' VAL . 0.3 OUTLIER -87.91 118.04 27.18 Favored 'General case' 0 CA--C 1.565 1.55 0 C-N-CA 124.775 1.23 . . . . 0.0 111.201 -178.448 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -83.76 44.2 0.97 Allowed 'General case' 0 CA--C 1.584 2.255 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 176.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.412 0.7 OUTLIER 106.54 176.65 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.699 0 C-N-CA 128.842 2.857 . . . . 0.0 112.167 -174.808 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 28.1 mm -54.07 -67.54 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.527 0 O-C-N 119.532 -1.98 . . . . 0.0 115.296 -173.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 pp -97.68 49.97 1.04 Allowed 'General case' 0 N--CA 1.509 2.486 0 CA-C-N 120.517 1.508 . . . . 0.0 113.451 176.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.2 p -102.33 -3.52 27.02 Favored 'General case' 0 N--CA 1.492 1.663 1 N-CA-C 121.906 4.039 . . . . 0.0 121.906 -172.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 21.7 tp 70.6 120.16 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.174 0 CA-C-N 120.288 1.403 . . . . 0.0 109.566 -173.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.615 ' HB3' HG11 ' A' ' 57' ' ' VAL . 50.7 m -94.78 124.63 38.93 Favored 'General case' 0 CA--C 1.561 1.386 0 O-C-N 120.377 -1.452 . . . . 0.0 114.741 -172.322 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.3 ttt85 -132.1 134.21 45.2 Favored 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 124.43 1.092 . . . . 0.0 110.283 -175.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.525 ' SG ' ' HA ' ' A' ' 28' ' ' CYS . 89.3 m -70.35 151.04 45.68 Favored 'General case' 0 CA--C 1.56 1.355 0 O-C-N 119.511 -1.993 . . . . 0.0 114.224 177.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.29 -174.21 3.88 Favored 'General case' 0 CA--C 1.565 1.531 0 CA-C-N 113.031 -1.895 . . . . 0.0 113.374 -173.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.5 mt -79.58 149.4 31.39 Favored 'General case' 0 CA--C 1.57 1.737 0 CA-C-O 122.225 1.012 . . . . 0.0 112.191 175.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -69.35 153.25 43.89 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 175.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.07 151.51 40.15 Favored 'General case' 0 CA--C 1.57 1.743 0 CA-C-O 124.242 1.972 . . . . 0.0 113.941 -174.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -118.99 168.41 10.83 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-N 113.427 -1.715 . . . . 0.0 110.968 -175.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -53.1 120.9 6.47 Favored 'General case' 0 CA--C 1.571 1.774 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -173.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 79.48 25.53 0.42 Allowed 'General case' 0 N--CA 1.505 2.317 0 C-N-CA 125.439 1.496 . . . . 0.0 113.789 -172.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.7 t -126.61 154.1 44.42 Favored 'General case' 0 CA--C 1.567 1.618 0 O-C-N 120.378 -1.451 . . . . 0.0 110.492 174.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -64.59 130.84 45.19 Favored 'General case' 0 CA--C 1.574 1.883 0 N-CA-C 116.764 2.135 . . . . 0.0 116.764 -173.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.55 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 24.5 p -141.04 141.99 34.25 Favored 'General case' 0 CA--C 1.563 1.47 0 CA-C-N 113.112 -1.858 . . . . 0.0 113.099 177.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.5 t -87.01 134.39 33.49 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 170.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.43 -26.16 62.63 Favored 'General case' 0 CA--C 1.578 2.027 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 -177.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -127.46 157.37 40.24 Favored 'General case' 0 CA--C 1.572 1.801 0 C-N-CA 125.448 1.499 . . . . 0.0 107.897 172.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 17.6 p -129.24 160.46 32.88 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 124.146 1.927 . . . . 0.0 110.308 172.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.288 0.7 OUTLIER -96.49 -121.99 0.12 Allowed 'General case' 0 CA--C 1.575 1.917 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 174.347 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.37 3.15 2.56 Favored 'General case' 0 CA--C 1.589 2.452 0 O-C-N 119.62 -1.925 . . . . 0.0 112.622 171.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -99.85 -162.12 28.83 Favored Glycine 0 N--CA 1.481 1.675 0 O-C-N 120.557 -1.339 . . . . 0.0 113.403 -175.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.615 HG11 ' HB3' ' A' ' 37' ' ' SER . 4.9 t -79.41 137.42 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 CA-C-O 123.093 1.425 . . . . 0.0 109.86 -175.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -111.58 140.25 46.35 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -171.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -71.99 -1.73 15.62 Favored 'General case' 0 CA--C 1.587 2.389 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 174.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.3 123.62 0.97 Allowed 'General case' 0 CA--C 1.574 1.883 0 C-N-CA 127.879 2.472 . . . . 0.0 107.104 -174.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 36.2 m -70.73 129.07 90.27 Favored Pre-proline 0 CA--C 1.594 2.661 0 O-C-N 118.973 -2.33 . . . . 0.0 111.032 173.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -76.41 76.5 3.91 Favored 'Trans proline' 0 CA--C 1.573 2.427 0 N-CA-C 119.236 2.745 . . . . 0.0 119.236 -172.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 58.5 m 60.4 145.39 0.01 OUTLIER 'General case' 0 CA--C 1.578 2.041 0 N-CA-C 116.998 2.222 . . . . 0.0 116.998 174.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -65.78 162.01 19.65 Favored 'General case' 0 CA--C 1.578 2.038 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 174.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -63.02 109.28 1.43 Allowed 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.768 -1.207 . . . . 0.0 112.503 -177.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 112.92 -23.39 14.57 Favored Glycine 0 N--CA 1.498 2.812 0 N-CA-C 117.606 1.802 . . . . 0.0 117.606 -173.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.3 tp -99.1 143.22 29.62 Favored 'General case' 0 CA--C 1.572 1.79 0 CA-C-N 118.509 1.154 . . . . 0.0 111.625 -178.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -98.54 159.11 15.17 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.472 -1.393 . . . . 0.0 114.087 -174.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 10.4 t -93.8 123.7 37.31 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.687 172.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 . . . . . 0 N--CA 1.489 1.51 0 O-C-N 120.711 -1.243 . . . . 0.0 108.782 176.266 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 . . . . . 0 CA--C 1.571 1.786 0 CA-C-O 122.027 0.918 . . . . 0.0 112.883 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.65 -179.2 3.23 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 118.518 2.167 . . . . 0.0 118.518 178.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 39.3 mm -126.32 139.2 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.283 -1.128 . . . . 0.0 110.461 -174.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.55 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 59.7 m -69.11 128.35 36.33 Favored 'General case' 0 CA--C 1.57 1.717 0 O-C-N 120.291 -1.506 . . . . 0.0 114.464 174.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -141.7 158.99 43.13 Favored 'General case' 0 CA--C 1.565 1.547 0 CA-C-O 123.309 1.528 . . . . 0.0 111.922 175.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -97.65 128.14 44.13 Favored 'General case' 0 CA--C 1.562 1.433 0 CA-C-O 122.669 1.223 . . . . 0.0 111.385 178.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 12.3 p . . . . . 0 N--CA 1.493 1.718 0 CA-C-O 123.044 1.402 . . . . 0.0 109.093 177.418 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.3 0.5 OUTLIER . . . . . 0 N--CA 1.5 2.045 0 N-CA-C 116.952 2.204 . . . . 0.0 116.952 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.5 tp -129.77 126.21 37.62 Favored 'General case' 0 CA--C 1.574 1.895 0 C-N-CA 124.49 1.116 . . . . 0.0 108.934 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -80.31 167.34 20.38 Favored 'General case' 0 CA--C 1.573 1.862 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -174.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -63.72 138.15 58.37 Favored 'General case' 0 CA--C 1.572 1.815 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -176.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.81 -11.33 38.25 Favored Glycine 0 N--CA 1.496 2.653 0 N-CA-C 118.391 2.116 . . . . 0.0 118.391 -175.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 82.3 mm-40 -100.21 137.42 38.67 Favored 'General case' 0 CA--C 1.564 1.506 0 CA-C-N 118.99 1.395 . . . . 0.0 111.081 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 77.7 mt -67.45 134.3 51.14 Favored 'General case' 0 CA--C 1.573 1.853 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -174.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.5 p -122.97 177.84 5.32 Favored 'General case' 0 CA--C 1.573 1.849 0 CA-C-O 123.029 1.395 . . . . 0.0 113.408 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.9 mt -109.45 -74.41 0.66 Allowed 'General case' 0 CA--C 1.574 1.889 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 171.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.1 p30 -91.39 -173.23 3.53 Favored 'General case' 0 CA--C 1.581 2.154 0 C-N-CA 124.607 1.163 . . . . 0.0 113.181 172.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.8 t -94.4 -4.94 47.49 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 116.921 2.193 . . . . 0.0 116.921 174.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.44 1.87 15.24 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 117.382 2.364 . . . . 0.0 117.382 174.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -95.27 -20.92 18.78 Favored 'General case' 0 CA--C 1.57 1.717 0 N-CA-C 115.966 1.839 . . . . 0.0 115.966 -175.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.0 m -81.44 -131.72 0.03 OUTLIER 'General case' 0 CA--C 1.579 2.074 0 CA-C-N 121.236 1.834 . . . . 0.0 114.124 -175.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -72.73 -82.8 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.354 0 O-C-N 119.423 -2.048 . . . . 0.0 111.328 -177.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.6 p -88.79 -63.07 1.35 Allowed 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 121.966 0.889 . . . . 0.0 110.744 172.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -170.05 84.81 0.12 Allowed 'General case' 0 CA--C 1.569 1.706 0 N-CA-C 105.159 -2.163 . . . . 0.0 105.159 178.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.414 ' SG ' ' HB3' ' A' ' 40' ' ' ALA . 41.9 t -155.32 94.44 1.61 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 119.825 -1.797 . . . . 0.0 115.118 -176.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.513 ' HB3' HG13 ' A' ' 57' ' ' VAL . 9.8 t -114.81 139.39 49.77 Favored 'General case' 0 CA--C 1.56 1.364 0 CA-C-O 121.759 0.79 . . . . 0.0 108.988 171.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.46 124.61 29.06 Favored 'General case' 0 CA--C 1.573 1.837 0 CA-C-O 122.106 0.955 . . . . 0.0 109.124 174.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.71 ' HA ' ' CG1' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -27.45 4.93 0.0 OUTLIER 'General case' 0 CA--C 1.592 2.586 3 N-CA-C 142.845 11.794 . . . . 0.0 142.845 -166.852 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . 0.261 1.3 p30 -24.65 72.49 0.0 OUTLIER 'General case' 0 N--CA 1.531 3.592 2 CA-C-N 131.633 6.56 . . . . 0.0 125.005 -167.732 . . . . . . . . 3 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.4 t -139.85 14.74 2.49 Favored 'General case' 0 CA--C 1.583 2.235 0 CA-C-N 114.05 -1.432 . . . . 0.0 113.957 173.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.0 pt -140.12 -59.04 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 CA-C-N 120.054 1.297 . . . . 0.0 111.535 174.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 93.8 mt -131.86 -68.22 0.65 Allowed 'General case' 0 N--CA 1.498 1.936 0 CA-C-N 120.513 1.506 . . . . 0.0 113.171 -174.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.7 p -90.01 163.95 14.71 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 -174.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.6 tp -66.98 163.02 20.71 Favored 'General case' 0 CA--C 1.584 2.282 0 O-C-N 121.517 -0.739 . . . . 0.0 111.9 173.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.1 m -91.96 127.62 37.5 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 119.885 -1.759 . . . . 0.0 111.732 -172.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -111.66 154.51 24.82 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.86 174.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 55.7 m -63.57 151.5 41.35 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 118.751 -2.468 . . . . 0.0 112.099 174.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.414 ' HB3' ' SG ' ' A' ' 27' ' ' CYS 0.275 . . -133.82 -172.64 3.03 Favored 'General case' 0 CA--C 1.567 1.612 0 CA-C-N 113.123 -1.853 . . . . 0.0 110.663 -175.88 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 94.4 mt -125.0 150.42 46.72 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.856 -1.152 . . . . 0.0 112.008 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -63.9 144.03 57.39 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.383 -0.823 . . . . 0.0 111.456 173.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.96 147.03 35.13 Favored 'General case' 0 CA--C 1.566 1.586 0 CA-C-O 124.678 2.18 . . . . 0.0 116.246 -173.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -101.56 170.27 8.3 Favored 'General case' 0 CA--C 1.56 1.336 0 CA-C-N 111.449 -2.614 . . . . 0.0 111.161 -178.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -59.26 124.26 19.4 Favored 'General case' 0 CA--C 1.57 1.741 0 O-C-N 120.84 -1.162 . . . . 0.0 112.851 -175.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 83.21 22.01 0.17 Allowed 'General case' 0 N--CA 1.506 2.359 0 C-N-CA 125.602 1.561 . . . . 0.0 113.859 -172.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.4 t -121.28 150.1 41.91 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.059 -1.651 . . . . 0.0 111.657 174.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -69.08 141.7 54.66 Favored 'General case' 0 CA--C 1.57 1.713 0 CA-C-O 123.305 1.526 . . . . 0.0 113.391 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 8.5 p -140.33 148.81 41.91 Favored 'General case' 0 CA--C 1.564 1.514 0 CA-C-N 113.127 -1.851 . . . . 0.0 113.387 -175.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.5 p -77.26 110.51 12.03 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 120.878 -1.138 . . . . 0.0 108.421 173.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -76.3 20.23 0.22 Allowed 'General case' 0 CA--C 1.576 1.963 0 N-CA-C 120.46 3.504 . . . . 0.0 120.46 -172.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -158.1 -56.47 0.07 Allowed 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 124.869 1.268 . . . . 0.0 113.348 -174.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.8 p 72.29 147.12 0.08 Allowed 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 127.607 2.363 . . . . 0.0 113.702 -174.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -100.06 -139.24 0.32 Allowed 'General case' 0 CA--C 1.576 1.956 0 CA-C-N 113.143 -1.844 . . . . 0.0 107.04 172.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -136.78 68.82 1.42 Allowed 'General case' 0 CA--C 1.567 1.625 0 CA-C-O 123.796 1.76 . . . . 0.0 107.921 169.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -177.66 -156.96 17.52 Favored Glycine 0 CA--C 1.544 1.858 0 CA-C-N 113.781 -1.554 . . . . 0.0 111.522 -176.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.71 ' CG1' ' HA ' ' A' ' 30' ' ' HIS . 1.2 t -75.17 154.47 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.213 0 O-C-N 121.283 -1.127 . . . . 0.0 112.928 -171.003 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -123.11 139.1 54.41 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 116.581 2.067 . . . . 0.0 116.581 -171.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -68.71 -38.88 80.59 Favored 'General case' 0 N--CA 1.502 2.128 0 N-CA-C 113.853 1.056 . . . . 0.0 113.853 172.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -143.01 109.14 5.24 Favored 'General case' 0 CA--C 1.563 1.479 0 N-CA-C 104.381 -2.451 . . . . 0.0 104.381 174.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 49.2 m -52.23 150.81 7.88 Favored Pre-proline 0 CA--C 1.588 2.415 0 N-CA-C 116.085 1.883 . . . . 0.0 116.085 178.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -63.25 166.28 15.21 Favored 'Trans proline' 0 CA--C 1.572 2.385 0 C-N-CA 122.308 2.005 . . . . 0.0 115.924 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 80.3 m -69.2 150.73 47.16 Favored 'General case' 0 CA--C 1.572 1.805 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 178.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -71.24 163.47 27.58 Favored 'General case' 0 CA--C 1.573 1.857 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 174.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -54.55 118.55 4.26 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 -174.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.04 -29.49 9.66 Favored Glycine 0 CA--C 1.556 2.648 0 CA-C-N 114.153 -1.385 . . . . 0.0 115.851 -172.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.9 mp -99.57 144.11 29.05 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-O 122.77 1.271 . . . . 0.0 112.115 -177.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -112.16 159.14 18.84 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 124.16 0.984 . . . . 0.0 112.607 -177.079 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 3.0 t -88.83 80.79 7.08 Favored 'General case' 0 CA--C 1.575 1.926 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 177.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 . . . . . 0 CA--C 1.569 1.675 0 O-C-N 120.932 -1.105 . . . . 0.0 113.307 -174.557 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 . . . . . 0 N--CA 1.498 1.928 0 CA-C-O 122.495 1.14 . . . . 0.0 111.977 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -78.74 163.92 50.1 Favored Glycine 0 N--CA 1.489 2.205 0 CA-C-N 115.762 -0.654 . . . . 0.0 114.595 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 35.2 mm -103.63 132.57 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 69.6 m -62.14 119.75 9.56 Favored 'General case' 0 CA--C 1.564 1.502 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 176.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -143.99 154.1 42.93 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-O 122.324 1.059 . . . . 0.0 110.82 175.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -92.89 87.51 5.83 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 123.761 1.744 . . . . 0.0 110.374 -174.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.4 t . . . . . 0 N--CA 1.493 1.679 0 CA-C-N 113.165 -1.834 . . . . 0.0 107.001 -174.765 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 71.7 m-80 . . . . . 0 CA--C 1.582 2.205 0 N-CA-C 118.015 2.598 . . . . 0.0 118.015 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 48.6 tp -103.27 142.82 33.54 Favored 'General case' 0 CA--C 1.58 2.107 0 O-C-N 119.734 -1.854 . . . . 0.0 109.178 173.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.86 179.68 7.7 Favored 'General case' 0 CA--C 1.572 1.798 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -174.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -74.4 168.47 19.63 Favored 'General case' 0 CA--C 1.575 1.916 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.97 13.63 74.28 Favored Glycine 0 CA--C 1.561 2.929 0 N-CA-C 117.13 1.612 . . . . 0.0 117.13 -172.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -117.91 143.27 46.48 Favored 'General case' 0 CA--C 1.567 1.609 0 C-N-CA 125.21 1.404 . . . . 0.0 110.504 -173.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.3 tt -71.94 131.11 42.5 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.872 -1.143 . . . . 0.0 111.271 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.54 ' SG ' ' O ' ' A' ' 19' ' ' ASN . 0.4 OUTLIER -135.96 154.25 51.16 Favored 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -173.751 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.5 mt -100.72 -67.56 0.85 Allowed 'General case' 0 CA--C 1.576 1.969 0 CA-C-N 113.622 -1.626 . . . . 0.0 108.983 171.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.54 ' O ' ' SG ' ' A' ' 17' ' ' CYS . 62.1 m-20 -108.18 -171.58 1.89 Allowed 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 120.776 1.625 . . . . 0.0 114.894 173.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.7 m -64.61 -30.69 71.71 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 118.92 -2.363 . . . . 0.0 113.769 172.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.31 43.34 1.01 Allowed 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 116.112 1.893 . . . . 0.0 116.112 173.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -117.7 -71.12 0.75 Allowed 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 102.281 -3.229 . . . . 0.0 102.281 171.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 34.7 m -84.89 81.04 9.06 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 103.437 -2.801 . . . . 0.0 103.437 167.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.7 mttm -66.76 5.92 0.56 Allowed 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 120.164 3.394 . . . . 0.0 120.164 -169.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.6 p -73.22 -72.93 0.23 Allowed 'General case' 0 CA--C 1.572 1.792 0 CA-C-O 118.613 -0.708 . . . . 0.0 109.14 171.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -166.68 14.44 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 115.981 1.845 . . . . 0.0 115.981 174.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 42.7 t -153.83 94.3 1.75 Allowed 'General case' 0 N--CA 1.499 2.019 0 CA-C-N 123.874 3.034 . . . . 0.0 117.973 -171.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.453 ' SG ' HG22 ' A' ' 57' ' ' VAL . 50.8 t -94.65 105.21 17.15 Favored 'General case' 0 CA--C 1.563 1.447 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 170.093 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.54 130.95 45.11 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 123.141 1.448 . . . . 0.0 112.824 -173.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 35.5 t60 -81.9 159.48 23.65 Favored 'General case' 0 CA--C 1.564 1.505 0 CA-C-O 122.815 1.293 . . . . 0.0 114.145 -174.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.3 p-10 -79.92 -51.42 9.12 Favored 'General case' 0 CA--C 1.57 1.717 0 CA-C-O 118.47 -0.776 . . . . 0.0 112.287 173.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -177.95 -65.37 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 124.589 1.156 . . . . 0.0 110.693 173.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 38.2 mm -133.01 -61.37 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 CA-C-N 121.042 1.746 . . . . 0.0 109.578 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.0 tp -71.06 102.4 2.45 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 120.192 1.36 . . . . 0.0 110.519 176.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 60.5 p -53.34 92.12 0.01 OUTLIER 'General case' 0 CA--C 1.573 1.856 1 N-CA-C 122.168 4.136 . . . . 0.0 122.168 -171.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 tt -125.5 87.03 2.63 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 101.865 -3.383 . . . . 0.0 101.865 171.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.7 m -99.98 136.39 39.96 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 -171.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -121.76 141.58 51.05 Favored 'General case' 0 CA--C 1.565 1.557 0 CA-C-N 114.707 -1.133 . . . . 0.0 108.347 174.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.7 m -79.55 146.31 32.69 Favored 'General case' 0 CA--C 1.556 1.174 0 O-C-N 119.492 -2.005 . . . . 0.0 113.831 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -135.64 -178.21 5.02 Favored 'General case' 0 CA--C 1.566 1.572 0 CA-C-N 113.841 -1.527 . . . . 0.0 113.996 -173.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.48 135.45 33.34 Favored 'General case' 0 CA--C 1.571 1.77 0 O-C-N 121.252 -0.905 . . . . 0.0 110.177 176.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.43 160.36 27.61 Favored 'General case' 0 CA--C 1.579 2.06 0 O-C-N 120.908 -1.12 . . . . 0.0 113.236 176.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.41 155.25 36.56 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 117.069 2.248 . . . . 0.0 117.069 -173.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 -117.18 175.77 5.45 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-N 112.889 -1.959 . . . . 0.0 110.696 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -58.38 128.1 35.45 Favored 'General case' 0 CA--C 1.57 1.748 0 O-C-N 120.651 -1.28 . . . . 0.0 113.631 -174.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 82.5 11.06 0.61 Allowed 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 125.748 1.619 . . . . 0.0 114.217 -173.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.7 t -110.36 147.16 34.5 Favored 'General case' 0 CA--C 1.563 1.458 0 O-C-N 120.143 -1.598 . . . . 0.0 111.988 175.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -80.11 110.56 15.63 Favored 'General case' 0 CA--C 1.57 1.734 0 CA-C-O 123.114 1.435 . . . . 0.0 112.449 -177.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.2 152.29 20.06 Favored 'General case' 0 CA--C 1.563 1.456 0 C-N-CA 125.926 1.69 . . . . 0.0 112.464 174.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.5 t -79.46 103.08 9.13 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 171.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.96 -38.51 69.76 Favored 'General case' 0 CA--C 1.566 1.562 0 N-CA-C 118.413 2.745 . . . . 0.0 118.413 -171.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.4 p90 -80.94 61.38 4.52 Favored 'General case' 0 CA--C 1.571 1.779 0 C-N-CA 124.728 1.211 . . . . 0.0 113.132 175.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.9 p -68.95 135.26 50.69 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 119.005 -2.309 . . . . 0.0 112.581 -174.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.307 0.5 OUTLIER -94.87 -135.32 0.2 Allowed 'General case' 0 CA--C 1.565 1.556 0 CA-C-N 111.551 -2.568 . . . . 0.0 107.272 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -139.45 73.57 1.44 Allowed 'General case' 0 CA--C 1.561 1.38 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 169.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -172.98 -140.6 3.2 Favored Glycine 0 N--CA 1.482 1.756 0 CA-C-N 115.3 -0.864 . . . . 0.0 113.333 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.453 HG22 ' SG ' ' A' ' 28' ' ' CYS . 3.4 t -87.56 142.98 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 CA-C-O 122.89 1.329 . . . . 0.0 111.139 -178.223 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -117.85 132.66 56.41 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-O 122.515 1.15 . . . . 0.0 110.353 -174.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -62.21 -43.68 98.28 Favored 'General case' 0 CA--C 1.581 2.148 0 CA-C-N 115.604 -0.725 . . . . 0.0 112.913 174.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -137.1 110.91 8.15 Favored 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 103.46 -2.793 . . . . 0.0 103.46 172.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 51.3 m -51.4 152.68 4.26 Favored Pre-proline 0 CA--C 1.593 2.605 0 N-CA-C 116.911 2.189 . . . . 0.0 116.911 -176.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.62 -173.8 0.4 Allowed 'Trans proline' 0 CA--C 1.572 2.407 0 C-N-CA 122.851 2.368 . . . . 0.0 116.619 -174.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 70.2 m -80.08 155.62 27.45 Favored 'General case' 0 CA--C 1.573 1.834 0 O-C-N 120.427 -1.42 . . . . 0.0 113.56 -178.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.86 -178.8 2.0 Favored 'General case' 0 CA--C 1.578 2.055 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 -175.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.95 112.46 3.31 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.364 -1.46 . . . . 0.0 112.562 -175.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 86.55 29.26 24.77 Favored Glycine 0 CA--C 1.556 2.637 0 N-CA-C 117.435 1.734 . . . . 0.0 117.435 -173.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.9 tp -141.11 141.35 34.21 Favored 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 118.812 1.306 . . . . 0.0 111.083 -176.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.74 158.32 16.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.674 -1.266 . . . . 0.0 113.219 -176.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 4.3 t -91.09 95.35 10.04 Favored 'General case' 0 CA--C 1.575 1.933 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 173.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 . . . . . 0 N--CA 1.498 1.943 0 N-CA-C 118.561 2.8 . . . . 0.0 118.561 -171.074 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 . . . . . 0 N--CA 1.495 1.786 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -125.01 160.46 19.63 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 118.184 2.034 . . . . 0.0 118.184 -177.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.5 mm -91.96 129.57 42.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 O-C-N 120.989 -1.301 . . . . 0.0 109.675 -172.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.6 m -64.04 124.52 21.81 Favored 'General case' 0 CA--C 1.567 1.618 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 177.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 72.8 m-70 -143.8 161.37 38.8 Favored 'General case' 0 CA--C 1.565 1.55 0 CA-C-O 123.462 1.601 . . . . 0.0 111.988 175.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -98.08 131.47 44.45 Favored 'General case' 0 CA--C 1.563 1.448 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.145 175.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.7 t . . . . . 0 N--CA 1.5 2.039 0 CA-C-O 123.068 1.413 . . . . 0.0 108.566 -179.194 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.25 62.5 m-80 . . . . . 0 N--CA 1.502 2.149 0 CA-C-O 121.61 0.719 . . . . 0.0 110.297 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -139.98 158.15 44.53 Favored 'General case' 0 CA--C 1.573 1.841 0 CA-C-O 122.771 1.272 . . . . 0.0 110.987 173.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -79.69 162.13 25.39 Favored 'General case' 0 CA--C 1.566 1.588 0 N-CA-C 115.237 1.569 . . . . 0.0 115.237 -173.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -78.18 126.51 30.91 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-O 122.403 1.097 . . . . 0.0 109.741 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 114.91 19.09 6.12 Favored Glycine 0 CA--C 1.559 2.79 0 N-CA-C 116.019 1.168 . . . . 0.0 116.019 -172.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -135.08 149.97 50.16 Favored 'General case' 0 CA--C 1.569 1.693 0 CA-C-N 119.215 1.507 . . . . 0.0 111.181 -178.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mp -73.48 147.21 44.31 Favored 'General case' 0 CA--C 1.575 1.926 0 N-CA-C 114.093 1.146 . . . . 0.0 114.093 -178.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 4.0 p -135.73 -175.08 3.84 Favored 'General case' 0 CA--C 1.574 1.901 0 CA-C-O 122.767 1.27 . . . . 0.0 114.234 -174.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.5 mt -109.31 -76.96 0.6 Allowed 'General case' 0 CA--C 1.575 1.921 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 170.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.2 p30 -96.1 -178.43 4.33 Favored 'General case' 0 CA--C 1.584 2.267 0 N-CA-C 114.908 1.448 . . . . 0.0 114.908 172.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 t -85.42 -17.54 36.3 Favored 'General case' 0 N--CA 1.503 2.206 0 N-CA-C 117.358 2.355 . . . . 0.0 117.358 174.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.14 9.75 2.35 Favored 'General case' 0 CA--C 1.577 1.998 0 N-CA-C 116.771 2.138 . . . . 0.0 116.771 174.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -97.0 -31.44 12.52 Favored 'General case' 0 CA--C 1.567 1.611 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.7 m -68.7 170.48 9.31 Favored 'General case' 0 CA--C 1.581 2.171 0 CA-C-N 121.232 1.833 . . . . 0.0 113.586 174.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -65.85 -65.25 0.7 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.034 -1.666 . . . . 0.0 108.751 172.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 83.4 p -83.65 107.49 16.13 Favored 'General case' 0 CA--C 1.566 1.588 0 N-CA-C 102.866 -3.013 . . . . 0.0 102.866 168.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -66.15 79.29 0.09 Allowed 'General case' 0 N--CA 1.501 2.089 0 CA-C-O 124.746 2.212 . . . . 0.0 115.596 -171.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 36.4 t -143.19 89.77 2.13 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 112.083 -2.326 . . . . 0.0 111.22 174.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.2 t -86.78 114.57 23.56 Favored 'General case' 0 CA--C 1.555 1.163 0 N-CA-C 102.688 -3.079 . . . . 0.0 102.688 169.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -96.97 123.65 40.74 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-O 123.525 1.631 . . . . 0.0 112.34 -171.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.449 ' HB2' HG12 ' A' ' 57' ' ' VAL . 13.5 t60 -83.18 141.85 31.62 Favored 'General case' 0 CA--C 1.558 1.286 0 CA-C-N 114.079 -1.419 . . . . 0.0 113.865 -174.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -68.51 17.26 0.04 OUTLIER 'General case' 0 CA--C 1.586 2.353 0 N-CA-C 117.46 2.393 . . . . 0.0 117.46 172.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.263 42.8 p 65.54 65.99 0.54 Allowed 'General case' 0 N--CA 1.499 2.023 0 C-N-CA 126.103 1.761 . . . . 0.0 112.866 -177.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.336 13.4 mt 78.62 151.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.511 2.597 0 C-N-CA 125.188 1.395 . . . . 0.0 110.256 -179.1 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.8 tp 66.46 75.4 0.33 Allowed 'General case' 0 N--CA 1.51 2.571 0 O-C-N 120.197 -1.564 . . . . 0.0 108.587 -172.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.0 p -48.11 100.56 0.02 OUTLIER 'General case' 0 CA--C 1.574 1.885 1 N-CA-C 123.457 4.614 . . . . 0.0 123.457 -170.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 30.6 tp -132.42 82.79 2.03 Favored 'General case' 0 CA--C 1.572 1.79 0 N-CA-C 101.645 -3.465 . . . . 0.0 101.645 170.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.0 m -99.85 131.72 45.65 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 -171.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -135.48 136.12 41.02 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 123.976 0.91 . . . . 0.0 110.981 -174.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 60.6 m -63.25 136.64 57.83 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 119.873 -1.767 . . . . 0.0 112.985 176.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.86 179.78 6.66 Favored 'General case' 0 CA--C 1.565 1.533 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -173.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -76.45 164.44 25.98 Favored 'General case' 0 CA--C 1.571 1.759 0 CA-C-O 122.417 1.103 . . . . 0.0 113.962 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.91 163.14 28.59 Favored 'General case' 0 CA--C 1.567 1.612 0 N-CA-C 115.078 1.51 . . . . 0.0 115.078 179.039 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.4 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . . . -81.03 142.84 32.98 Favored 'General case' 0 CA--C 1.564 1.489 0 CA-C-O 123.822 1.772 . . . . 0.0 113.434 177.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -96.65 164.14 12.71 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-N 113.739 -1.573 . . . . 0.0 112.173 -174.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -53.98 123.97 14.14 Favored 'General case' 0 CA--C 1.571 1.772 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -174.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 84.6 18.77 0.15 Allowed 'General case' 0 N--CA 1.508 2.444 0 C-N-CA 126.056 1.742 . . . . 0.0 113.949 -172.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.9 t -119.95 150.82 39.89 Favored 'General case' 0 CA--C 1.566 1.591 0 O-C-N 120.203 -1.56 . . . . 0.0 112.211 174.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -67.13 141.14 57.51 Favored 'General case' 0 CA--C 1.57 1.738 0 CA-C-O 122.886 1.327 . . . . 0.0 114.315 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -129.44 139.09 51.74 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-N 113.861 -1.518 . . . . 0.0 112.811 -176.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.8 t -87.82 85.56 7.05 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-O 122.171 0.986 . . . . 0.0 109.981 174.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.48 -33.05 64.63 Favored 'General case' 0 CA--C 1.571 1.752 0 N-CA-C 119.479 3.14 . . . . 0.0 119.479 -173.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -78.8 153.93 30.31 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 125.502 1.521 . . . . 0.0 112.915 174.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.1 p -112.44 125.4 54.17 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 123.338 1.542 . . . . 0.0 109.8 172.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.513 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.7 pt? -99.64 -159.41 0.74 Allowed 'General case' 0 CA--C 1.576 1.972 0 CA-C-N 112.655 -2.066 . . . . 0.0 106.738 171.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -112.49 64.42 0.63 Allowed 'General case' 0 N--CA 1.5 2.049 0 O-C-N 119.634 -1.916 . . . . 0.0 106.109 171.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 178.89 -165.83 35.1 Favored Glycine 0 CA--C 1.542 1.757 0 CA-C-N 113.724 -1.58 . . . . 0.0 114.872 -173.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.449 HG12 ' HB2' ' A' ' 30' ' ' HIS . 44.4 t -92.87 156.23 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 CA-C-O 123.314 1.531 . . . . 0.0 113.171 -166.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 17.6 m-30 -106.44 140.76 38.84 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 114.797 -1.092 . . . . 0.0 113.742 -176.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -71.58 -59.16 2.9 Favored 'General case' 0 CA--C 1.575 1.911 0 O-C-N 121.23 -0.919 . . . . 0.0 113.051 175.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.96 119.62 30.95 Favored 'General case' 0 CA--C 1.567 1.621 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 174.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 55.1 m -49.46 153.34 1.92 Allowed Pre-proline 0 CA--C 1.588 2.432 0 N-CA-C 120.064 3.357 . . . . 0.0 120.064 -177.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -58.23 169.47 2.9 Favored 'Trans proline' 0 CA--C 1.573 2.453 0 C-N-CA 123.216 2.611 . . . . 0.0 115.573 172.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 2.7 m -94.02 107.16 19.1 Favored 'General case' 0 CA--C 1.577 1.985 0 O-C-N 120.397 -1.439 . . . . 0.0 109.19 175.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.401 0.0 OUTLIER -83.86 -63.16 1.4 Allowed 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 120.961 3.689 . . . . 0.0 120.961 -171.32 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.89 82.11 7.65 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.245 -1.535 . . . . 0.0 114.957 -173.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 71.24 33.26 64.85 Favored Glycine 0 N--CA 1.495 2.616 0 N-CA-C 119.339 2.495 . . . . 0.0 119.339 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.4 mp -122.33 143.98 49.29 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 122.51 1.147 . . . . 0.0 111.464 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.63 155.82 17.86 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 122.227 1.013 . . . . 0.0 112.55 177.325 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 3.5 t -94.88 86.99 4.83 Favored 'General case' 0 CA--C 1.575 1.941 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.421 175.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 . . . . . 0 N--CA 1.492 1.668 0 O-C-N 120.514 -1.366 . . . . 0.0 112.98 -173.556 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 . . . . . 0 CA--C 1.57 1.745 0 CA-C-O 121.913 0.864 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -89.95 155.24 24.42 Favored Glycine 0 N--CA 1.499 2.867 0 O-C-N 120.922 -1.111 . . . . 0.0 114.614 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 29.5 mm -94.45 130.83 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 120.232 -1.746 . . . . 0.0 110.931 -170.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.4 ' SG ' ' HB3' ' A' ' 43' ' ' ALA . 95.8 m -61.11 120.53 10.48 Favored 'General case' 0 CA--C 1.566 1.576 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 175.109 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -144.52 143.54 30.9 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 122.481 1.134 . . . . 0.0 110.617 174.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -95.67 77.32 3.28 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 124.279 1.99 . . . . 0.0 111.792 -174.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.9 m . . . . . 0 CA--C 1.577 1.991 0 N-CA-C 117.161 2.282 . . . . 0.0 117.161 -177.714 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 . . . . . 0 N--CA 1.494 1.758 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.2 tp -154.05 118.63 4.91 Favored 'General case' 0 CA--C 1.574 1.895 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 175.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -74.04 164.82 26.14 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -173.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 mp0 -69.86 132.84 46.64 Favored 'General case' 0 CA--C 1.567 1.604 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.891 -174.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.04 -10.29 51.46 Favored Glycine 0 N--CA 1.497 2.703 0 N-CA-C 117.18 1.632 . . . . 0.0 117.18 -173.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -99.23 144.11 28.73 Favored 'General case' 0 CA--C 1.566 1.569 0 CA-C-N 118.983 1.392 . . . . 0.0 110.843 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.5 mp -67.29 136.21 54.53 Favored 'General case' 0 CA--C 1.575 1.915 0 N-CA-C 113.904 1.075 . . . . 0.0 113.904 -175.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 11.7 p -137.92 144.57 41.34 Favored 'General case' 0 CA--C 1.565 1.522 0 C-N-CA 124.034 0.934 . . . . 0.0 112.122 -177.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 78.1 mt -82.99 -66.1 0.93 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.253 -0.904 . . . . 0.0 112.155 176.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -98.76 165.33 11.84 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 120.002 1.274 . . . . 0.0 113.198 174.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -74.92 -13.4 60.53 Favored 'General case' 0 N--CA 1.506 2.371 0 N-CA-C 116.301 1.963 . . . . 0.0 116.301 172.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.55 30.79 0.41 Allowed 'General case' 0 CA--C 1.58 2.098 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 172.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -127.95 -23.76 3.3 Favored 'General case' 0 CA--C 1.571 1.751 0 CA-C-O 116.767 -1.587 . . . . 0.0 114.863 -175.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 57.0 m -73.31 -144.99 0.02 OUTLIER 'General case' 0 CA--C 1.587 2.402 0 CA-C-N 122.23 2.287 . . . . 0.0 113.254 176.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -83.57 -67.64 0.77 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 118.759 -2.463 . . . . 0.0 114.233 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 61.9 p -84.66 -74.21 0.4 Allowed 'General case' 0 CA--C 1.566 1.584 0 O-C-N 121.248 -0.908 . . . . 0.0 111.235 174.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.5 t-20 -172.76 77.8 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 C-N-CA 124.731 1.212 . . . . 0.0 109.521 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.8 t -160.29 98.04 1.26 Allowed 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 121.259 1.845 . . . . 0.0 115.798 173.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.8 t -101.11 117.43 34.99 Favored 'General case' 0 CA--C 1.562 1.405 0 N-CA-C 103.046 -2.946 . . . . 0.0 103.046 169.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 65.1 tp60 -94.94 113.09 24.76 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.363 1.065 . . . . 0.0 113.739 -173.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.534 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.1 t60 -81.85 135.01 35.46 Favored 'General case' 0 CA--C 1.56 1.361 0 CA-C-N 114.741 -1.118 . . . . 0.0 111.119 176.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.4 p-10 -73.09 -75.53 0.14 Allowed 'General case' 0 CA--C 1.574 1.885 0 CA-C-O 118.326 -0.845 . . . . 0.0 113.043 174.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.5 t -169.5 92.6 0.25 Allowed 'General case' 0 N--CA 1.502 2.142 0 CA-C-N 120.906 1.685 . . . . 0.0 111.51 -177.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.305 3.8 mp 70.65 -69.06 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 C-N-CA 125.427 1.491 . . . . 0.0 111.348 174.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.4 mp -69.08 109.56 4.07 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 120.304 1.411 . . . . 0.0 107.697 173.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 56.7 p -72.2 83.57 1.02 Allowed 'General case' 0 CA--C 1.567 1.617 0 N-CA-C 120.502 3.519 . . . . 0.0 120.502 -171.371 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.7 tp -104.99 81.13 1.7 Allowed 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 103.305 -2.85 . . . . 0.0 103.305 170.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 26.9 m -100.58 124.17 45.79 Favored 'General case' 0 CA--C 1.564 1.495 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -170.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 65.6 mtt85 -114.33 167.85 10.35 Favored 'General case' 0 N--CA 1.501 2.102 0 C-N-CA 124.05 0.94 . . . . 0.0 111.601 174.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 83.4 m -79.95 147.86 31.44 Favored 'General case' 0 CA--C 1.568 1.649 0 O-C-N 118.565 -2.584 . . . . 0.0 111.104 172.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.91 172.43 12.7 Favored 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 -174.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.1 mt -85.25 152.67 23.14 Favored 'General case' 0 CA--C 1.568 1.663 0 CA-C-O 122.2 1.0 . . . . 0.0 113.034 -178.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -64.88 146.31 55.08 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 178.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.91 155.11 33.05 Favored 'General case' 0 CA--C 1.564 1.504 0 CA-C-O 123.398 1.571 . . . . 0.0 114.848 -175.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -108.33 172.66 6.71 Favored 'General case' 0 CA--C 1.562 1.422 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.448 -174.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -52.7 126.72 20.78 Favored 'General case' 0 CA--C 1.572 1.814 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 -174.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 74.51 20.11 2.55 Favored 'General case' 0 N--CA 1.506 2.347 0 N-CA-C 114.858 1.429 . . . . 0.0 114.858 -173.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 37.3 t -115.41 153.37 31.18 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 120.524 -1.36 . . . . 0.0 111.188 174.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -64.46 136.92 57.55 Favored 'General case' 0 CA--C 1.57 1.722 0 CA-C-O 123.18 1.467 . . . . 0.0 113.017 176.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.463 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 17.0 p -138.19 139.96 39.56 Favored 'General case' 0 CA--C 1.559 1.312 0 CA-C-N 113.194 -1.821 . . . . 0.0 112.436 -176.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.1 t -75.14 90.39 2.53 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 122.991 1.377 . . . . 0.0 110.704 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.565 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . . . -76.56 -51.04 12.41 Favored 'General case' 0 CA--C 1.568 1.65 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 -173.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 54.0 p90 -79.25 -37.26 38.38 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 117.193 2.294 . . . . 0.0 117.193 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 80.4 p 62.84 144.04 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 127.034 2.134 . . . . 0.0 114.644 -174.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.23 -168.36 1.55 Allowed 'General case' 0 CA--C 1.567 1.632 0 CA-C-N 113.934 -1.485 . . . . 0.0 108.436 171.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -103.42 74.3 1.26 Allowed 'General case' 0 CA--C 1.567 1.62 0 N-CA-C 105.191 -2.152 . . . . 0.0 105.191 171.049 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 166.42 -160.18 33.68 Favored Glycine 0 N--CA 1.482 1.701 0 CA-C-O 122.388 0.993 . . . . 0.0 115.079 -174.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.534 HG12 ' HB2' ' A' ' 30' ' ' HIS . 13.3 t -83.91 143.98 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 CA-C-O 122.935 1.35 . . . . 0.0 112.32 -167.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -109.24 135.18 50.76 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.916 -174.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -74.51 -17.58 60.73 Favored 'General case' 0 CA--C 1.589 2.447 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 173.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm -147.67 119.21 7.94 Favored 'General case' 0 CA--C 1.572 1.817 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 174.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 74.4 m -55.51 151.11 21.79 Favored Pre-proline 0 CA--C 1.586 2.357 0 N-CA-C 117.366 2.358 . . . . 0.0 117.366 177.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -66.79 172.88 8.89 Favored 'Trans proline' 0 CA--C 1.576 2.61 0 C-N-CA 122.464 2.109 . . . . 0.0 115.623 174.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 34.1 m -74.7 154.67 38.34 Favored 'General case' 0 CA--C 1.579 2.065 0 O-C-N 120.63 -1.294 . . . . 0.0 114.481 -178.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.41 179.15 7.85 Favored 'General case' 0 CA--C 1.576 1.957 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 179.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -65.81 103.44 0.9 Allowed 'General case' 0 CA--C 1.572 1.813 0 O-C-N 120.49 -1.381 . . . . 0.0 113.02 -176.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 129.79 -45.68 1.12 Allowed Glycine 0 N--CA 1.494 2.559 0 CA-C-N 115.224 -0.898 . . . . 0.0 114.816 -173.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mp -93.75 139.44 30.84 Favored 'General case' 0 CA--C 1.562 1.411 0 CA-C-O 122.707 1.242 . . . . 0.0 111.338 -176.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.32 151.24 21.28 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 121.787 0.803 . . . . 0.0 112.414 -177.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.565 ' SG ' ' HB2' ' A' ' 51' ' ' ALA . 8.8 t -92.13 124.36 36.16 Favored 'General case' 0 CA--C 1.567 1.621 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.527 173.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 . . . . . 0 N--CA 1.492 1.643 0 O-C-N 120.702 -1.249 . . . . 0.0 107.672 -176.555 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 . . . . . 0 N--CA 1.493 1.686 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.12 -179.26 52.53 Favored Glycine 0 N--CA 1.493 2.454 0 O-C-N 121.786 -0.571 . . . . 0.0 113.677 172.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.0 mm -115.59 137.08 50.35 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.536 0 CA-C-N 119.455 1.627 . . . . 0.0 111.62 -174.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.463 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 57.0 m -69.56 126.83 30.92 Favored 'General case' 0 CA--C 1.569 1.696 0 O-C-N 120.813 -1.179 . . . . 0.0 114.179 174.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -141.33 156.05 45.88 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 122.905 1.336 . . . . 0.0 111.115 176.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -93.68 77.11 4.31 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-O 124.097 1.903 . . . . 0.0 111.629 -174.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 93.0 t . . . . . 0 N--CA 1.496 1.826 0 CA-C-N 112.246 -2.252 . . . . 0.0 109.04 -177.322 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 . . . . . 0 CA--C 1.581 2.15 0 N-CA-C 120.844 3.646 . . . . 0.0 120.844 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.4 tp -127.81 127.29 43.26 Favored 'General case' 0 CA--C 1.58 2.106 0 O-C-N 120.679 -1.263 . . . . 0.0 108.985 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -76.13 158.73 31.43 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 119.961 -1.712 . . . . 0.0 114.895 -174.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.26 136.22 54.59 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 122.028 0.918 . . . . 0.0 111.216 176.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.96 -7.85 67.56 Favored Glycine 0 CA--C 1.557 2.69 0 N-CA-C 116.558 1.383 . . . . 0.0 116.558 -172.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -97.66 142.72 29.12 Favored 'General case' 0 CA--C 1.567 1.599 0 CA-C-N 119.026 1.413 . . . . 0.0 110.167 178.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.4 mp -63.99 128.09 34.28 Favored 'General case' 0 CA--C 1.573 1.835 0 CA-C-O 122.14 0.971 . . . . 0.0 112.455 -178.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -129.11 157.85 40.6 Favored 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 123.741 1.734 . . . . 0.0 113.57 -173.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.3 mt -102.76 -64.97 1.02 Allowed 'General case' 0 CA--C 1.573 1.849 0 CA-C-N 114.269 -1.332 . . . . 0.0 107.598 170.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -98.97 148.83 23.59 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.481 ' HA ' ' HB2' ' A' ' 28' ' ' CYS . 2.8 t -68.29 -22.65 64.72 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 119.819 -1.801 . . . . 0.0 112.842 169.184 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . 0.3 . . -71.68 3.4 4.09 Favored 'General case' 0 CA--C 1.58 2.121 0 N-CA-C 115.725 1.75 . . . . 0.0 115.725 171.154 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -99.83 -37.52 9.03 Favored 'General case' 0 CA--C 1.575 1.928 0 C-N-CA 126.05 1.74 . . . . 0.0 113.206 173.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 12.5 m -76.46 157.37 32.27 Favored 'General case' 0 CA--C 1.572 1.795 0 N-CA-C 116.507 2.04 . . . . 0.0 116.507 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -68.54 -59.65 2.99 Favored 'General case' 0 N--CA 1.501 2.084 0 C-N-CA 124.307 1.043 . . . . 0.0 109.016 172.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.7 t -81.52 104.38 11.9 Favored 'General case' 0 CA--C 1.565 1.534 0 N-CA-C 103.0 -2.963 . . . . 0.0 103.0 168.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -70.88 82.01 0.65 Allowed 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 124.528 2.109 . . . . 0.0 113.071 -172.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 28.8 t -155.92 81.56 1.01 Allowed 'General case' 0 CA--C 1.56 1.336 0 CA-C-N 112.157 -2.292 . . . . 0.0 109.99 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.481 ' HB2' ' HA ' ' A' ' 20' ' ' SER . 18.0 t -78.84 114.2 17.57 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 104.785 -2.302 . . . . 0.0 104.785 172.03 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.03 109.27 16.21 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -171.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.461 ' HB2' HG12 ' A' ' 57' ' ' VAL . 39.4 t-80 -77.35 108.37 10.44 Favored 'General case' 0 CA--C 1.564 1.489 0 CA-C-O 122.244 1.021 . . . . 0.0 111.132 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.1 p-10 -64.82 42.71 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.341 0 N-CA-C 119.115 3.005 . . . . 0.0 119.115 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.8 p 67.17 84.22 0.16 Allowed 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 126.049 1.74 . . . . 0.0 113.725 173.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.273 4.3 mp 72.49 -48.56 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 C-N-CA 125.292 1.437 . . . . 0.0 113.63 177.099 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.8 mt -51.68 -27.47 11.79 Favored 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 118.33 2.715 . . . . 0.0 118.33 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.251 28.4 p 76.73 -2.6 2.66 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 118.988 2.958 . . . . 0.0 118.988 174.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.5 mp -73.95 95.01 2.41 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 121.041 1.746 . . . . 0.0 106.735 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.6 m -96.55 158.55 15.38 Favored 'General case' 0 CA--C 1.567 1.616 0 CA-C-O 122.874 1.321 . . . . 0.0 113.961 -170.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -141.55 138.39 32.65 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.675 -1.265 . . . . 0.0 110.922 -178.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 67.3 m -63.22 143.48 57.76 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 118.448 -2.658 . . . . 0.0 113.721 176.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.95 171.86 13.49 Favored 'General case' 0 CA--C 1.564 1.509 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -173.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -108.02 149.26 28.63 Favored 'General case' 0 CA--C 1.569 1.68 0 CA-C-N 114.481 -1.236 . . . . 0.0 110.793 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -53.38 142.59 21.24 Favored 'General case' 0 CA--C 1.577 2.007 0 N-CA-C 116.372 1.99 . . . . 0.0 116.372 176.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.4 168.79 19.43 Favored 'General case' 0 CA--C 1.574 1.882 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -174.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 63.1 mtt-85 -116.44 162.86 16.91 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.011 -1.056 . . . . 0.0 112.183 -177.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -55.4 126.76 26.48 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -175.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.265 66.9 m-80 77.76 20.82 1.01 Allowed 'General case' 0 CA--C 1.584 2.254 0 C-N-CA 125.267 1.427 . . . . 0.0 114.464 -173.15 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.0 t -119.51 155.15 32.68 Favored 'General case' 0 CA--C 1.565 1.529 0 O-C-N 120.477 -1.389 . . . . 0.0 110.742 173.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -61.93 130.01 43.64 Favored 'General case' 0 CA--C 1.566 1.568 0 CA-C-O 123.21 1.481 . . . . 0.0 114.479 -176.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.546 ' SG ' ' HA ' ' A' ' 62' ' ' PRO . 23.4 t -133.48 145.29 50.07 Favored 'General case' 0 CA--C 1.568 1.669 0 CA-C-N 113.022 -1.899 . . . . 0.0 112.752 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.5 m -120.57 137.65 54.29 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 105.245 -2.131 . . . . 0.0 105.245 171.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -82.07 -132.32 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.144 0 O-C-N 120.512 -1.368 . . . . 0.0 113.464 -174.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -133.15 156.25 47.8 Favored 'General case' 0 N--CA 1.491 1.584 1 N-CA-C 125.108 5.225 . . . . 0.0 125.108 -169.086 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.351 70.3 p 63.94 128.0 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.133 1 CA-C-N 108.115 -4.129 . . . . 0.0 115.165 -178.058 . . . . . . . . 3 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.346 0.4 OUTLIER -142.85 -81.08 0.2 Allowed 'General case' 0 CA--C 1.582 2.194 1 CA-C-N 108.228 -4.078 . . . . 0.0 100.683 -173.883 . . . . . . . . 4 3 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -159.22 -16.29 0.06 Allowed 'General case' 0 CA--C 1.611 3.312 0 C-N-CA 130.194 3.398 . . . . 0.0 107.907 169.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 118.0 58.48 0.28 Allowed Glycine 0 CA--C 1.562 2.982 0 C-N-CA 125.373 1.463 . . . . 0.0 113.773 -170.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.461 HG12 ' HB2' ' A' ' 30' ' ' HIS . 16.9 t -145.15 141.45 22.81 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.756 0 CA-C-N 121.791 2.796 . . . . 0.0 106.088 139.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -125.8 131.29 52.49 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 120.782 -1.198 . . . . 0.0 113.686 -172.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -69.1 -29.66 67.79 Favored 'General case' 0 CA--C 1.579 2.059 0 N-CA-C 116.133 1.901 . . . . 0.0 116.133 179.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -149.56 125.32 10.46 Favored 'General case' 0 CA--C 1.57 1.736 0 N-CA-C 105.823 -1.918 . . . . 0.0 105.823 174.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.2 m -55.23 152.19 16.15 Favored Pre-proline 0 CA--C 1.596 2.746 0 N-CA-C 116.797 2.147 . . . . 0.0 116.797 -175.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.546 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 44.2 Cg_endo -78.45 37.48 0.64 Allowed 'Trans proline' 0 CA--C 1.569 2.271 1 N-CA-C 122.786 4.11 . . . . 0.0 122.786 -171.188 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.478 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 29.8 m 64.42 144.17 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 -178.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -66.24 145.94 55.19 Favored 'General case' 0 CA--C 1.569 1.677 0 O-C-N 119.816 -1.802 . . . . 0.0 112.961 176.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -62.97 119.76 10.06 Favored 'General case' 0 CA--C 1.565 1.538 0 CA-C-O 123.737 1.732 . . . . 0.0 114.628 -172.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 138.69 -48.76 0.86 Allowed Glycine 0 N--CA 1.49 2.299 0 CA-C-N 112.461 -2.154 . . . . 0.0 113.804 -172.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -105.08 173.69 6.2 Favored 'General case' 0 CA--C 1.575 1.915 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 175.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -100.64 155.1 18.07 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -173.616 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 37.3 t -96.36 127.8 42.69 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-N 113.324 -1.762 . . . . 0.0 110.895 172.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 . . . . . 0 N--CA 1.499 2.018 0 CA-C-N 120.728 1.604 . . . . 0.0 111.649 174.639 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 . . . . . 0 N--CA 1.495 1.819 0 CA-C-O 122.039 0.923 . . . . 0.0 112.213 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -86.76 -164.32 39.76 Favored Glycine 0 N--CA 1.487 2.046 0 O-C-N 121.071 -1.018 . . . . 0.0 115.457 175.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 33.9 mm -125.89 152.71 33.26 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.058 0 CA-C-O 122.882 1.325 . . . . 0.0 110.29 -174.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.457 ' SG ' ' HB2' ' A' ' 49' ' ' CYS . 58.6 m -76.11 122.09 23.77 Favored 'General case' 0 CA--C 1.57 1.722 0 O-C-N 120.312 -1.493 . . . . 0.0 112.379 172.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -138.51 143.01 39.34 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 123.414 1.578 . . . . 0.0 111.092 178.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 -98.93 137.14 37.91 Favored 'General case' 0 CA--C 1.56 1.355 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.578 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 57.9 t . . . . . 0 N--CA 1.496 1.872 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.45 -174.029 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 . . . . . 0 N--CA 1.502 2.131 0 CA-C-O 121.827 0.823 . . . . 0.0 112.642 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -138.41 157.39 46.31 Favored 'General case' 0 CA--C 1.573 1.849 0 CA-C-O 122.664 1.221 . . . . 0.0 111.941 172.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -78.11 167.19 21.82 Favored 'General case' 0 CA--C 1.569 1.693 0 O-C-N 120.337 -1.477 . . . . 0.0 113.961 -175.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -74.82 148.32 40.38 Favored 'General case' 0 CA--C 1.578 2.02 0 CA-C-O 122.312 1.053 . . . . 0.0 110.762 174.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.52 28.2 10.74 Favored Glycine 0 CA--C 1.56 2.888 0 N-CA-C 114.979 0.752 . . . . 0.0 114.979 -171.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -139.39 146.22 39.91 Favored 'General case' 0 CA--C 1.568 1.636 0 C-N-CA 125.157 1.383 . . . . 0.0 109.698 -175.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.2 tt -69.68 119.18 13.52 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 120.657 -1.277 . . . . 0.0 111.721 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 14.6 p -120.92 158.42 27.72 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -175.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -88.64 -84.79 0.2 Allowed 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 174.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.7 p30 -94.03 169.78 10.02 Favored 'General case' 0 N--CA 1.499 2.004 0 C-N-CA 124.021 0.928 . . . . 0.0 113.11 173.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.7 m -72.03 -23.08 61.33 Favored 'General case' 0 N--CA 1.504 2.261 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 174.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.28 12.06 1.04 Allowed 'General case' 0 CA--C 1.583 2.245 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 173.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 31.3 mm100 -93.1 -47.56 6.91 Favored 'General case' 0 CA--C 1.569 1.702 0 C-N-CA 125.05 1.34 . . . . 0.0 112.737 174.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 70.9 m -72.55 154.28 40.88 Favored 'General case' 0 CA--C 1.57 1.75 0 CA-C-N 120.451 1.478 . . . . 0.0 113.705 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -54.44 -57.39 11.5 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.944 -1.097 . . . . 0.0 111.1 174.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.1 m -83.75 106.31 15.35 Favored 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 103.606 -2.739 . . . . 0.0 103.606 168.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -68.89 85.0 0.32 Allowed 'General case' 0 N--CA 1.495 1.804 0 CA-C-O 124.185 1.945 . . . . 0.0 113.718 -173.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.7 t -151.66 73.12 1.06 Allowed 'General case' 0 CA--C 1.564 1.497 0 CA-C-N 113.01 -1.904 . . . . 0.0 111.165 -174.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 35.9 t -79.49 113.69 17.83 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 104.482 -2.414 . . . . 0.0 104.482 171.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -100.1 112.8 25.11 Favored 'General case' 0 CA--C 1.567 1.626 0 CA-C-O 123.179 1.466 . . . . 0.0 114.656 -170.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.612 ' HB2' HG12 ' A' ' 57' ' ' VAL . 0.9 OUTLIER -82.46 144.66 30.3 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 126.118 1.767 . . . . 0.0 110.9 176.023 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -82.9 75.55 9.79 Favored 'General case' 0 CA--C 1.58 2.118 0 O-C-N 120.452 -1.405 . . . . 0.0 108.186 171.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.415 HG23 ' H ' ' A' ' 33' ' ' ILE 0.406 11.8 t 55.04 -106.63 0.34 Allowed 'General case' 0 N--CA 1.5 2.034 0 C-N-CA 126.275 1.83 . . . . 0.0 113.207 -173.293 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.415 ' H ' HG23 ' A' ' 32' ' ' THR . 0.2 OUTLIER -103.22 -18.11 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.291 0 CA-C-N 120.68 1.582 . . . . 0.0 114.042 174.256 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.1 tp -72.74 121.74 20.35 Favored 'General case' 0 CA--C 1.569 1.707 0 CA-C-N 121.24 1.836 . . . . 0.0 108.838 173.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 82.1 p -83.86 100.49 11.01 Favored 'General case' 0 CA--C 1.568 1.654 0 N-CA-C 118.823 2.897 . . . . 0.0 118.823 -171.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 38.9 tp -149.23 87.29 1.52 Allowed 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 102.63 -3.1 . . . . 0.0 102.63 171.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 m -100.3 122.16 42.64 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 -171.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -133.49 137.27 45.57 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 124.679 1.192 . . . . 0.0 109.163 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 63.4 m -66.04 142.65 57.74 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 119.501 -1.999 . . . . 0.0 113.28 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -137.69 -172.95 3.36 Favored 'General case' 0 CA--C 1.569 1.691 0 CA-C-N 113.433 -1.712 . . . . 0.0 112.754 -174.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 37.8 tp -90.9 150.8 21.37 Favored 'General case' 0 CA--C 1.573 1.836 0 CA-C-O 122.264 1.031 . . . . 0.0 112.457 176.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -70.38 155.31 40.86 Favored 'General case' 0 CA--C 1.574 1.866 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 173.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.46 150.63 36.67 Favored 'General case' 0 CA--C 1.571 1.762 0 CA-C-O 124.561 2.124 . . . . 0.0 114.043 -174.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -124.61 168.17 13.5 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.186 -1.824 . . . . 0.0 110.857 -175.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -54.41 133.98 45.61 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.907 -1.121 . . . . 0.0 112.616 -176.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.391 8.8 p30 67.77 17.41 9.77 Favored 'General case' 0 CA--C 1.585 2.326 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -171.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.1 t -118.14 153.3 34.03 Favored 'General case' 0 CA--C 1.567 1.607 0 O-C-N 120.78 -1.2 . . . . 0.0 110.253 173.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -60.01 122.67 14.9 Favored 'General case' 0 CA--C 1.572 1.802 0 N-CA-C 117.448 2.388 . . . . 0.0 117.448 -174.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.566 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 53.2 t -142.81 132.52 23.93 Favored 'General case' 0 CA--C 1.56 1.352 0 CA-C-N 113.816 -1.538 . . . . 0.0 110.848 173.226 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 27.9 t -139.69 158.74 43.6 Favored 'General case' 0 CA--C 1.568 1.666 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 172.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -119.13 126.36 51.42 Favored 'General case' 0 CA--C 1.571 1.751 0 CA-C-O 124.599 2.142 . . . . 0.0 112.169 -173.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 19.8 p90 -146.47 -142.16 0.12 Allowed 'General case' 0 CA--C 1.579 2.095 0 CA-C-N 111.942 -2.39 . . . . 0.0 108.324 -172.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.0 m -63.95 111.33 2.45 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 119.537 -1.977 . . . . 0.0 109.336 171.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.458 2.3 mt -112.1 42.16 1.82 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 117.83 2.53 . . . . 0.0 117.83 -178.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . 0.362 0.5 OUTLIER -153.7 29.87 0.47 Allowed 'General case' 0 CA--C 1.583 2.246 0 CA-C-N 113.353 -1.749 . . . . 0.0 112.141 166.541 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -123.18 -131.86 3.88 Favored Glycine 0 CA--C 1.548 2.155 0 N-CA-C 108.722 -1.751 . . . . 0.0 108.722 172.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.612 HG12 ' HB2' ' A' ' 30' ' ' HIS . 14.2 t -101.84 144.09 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.503 0 O-C-N 121.169 -1.195 . . . . 0.0 108.795 170.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 15.3 m-30 -114.21 136.9 52.44 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 -169.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.36 -48.6 55.59 Favored 'General case' 0 CA--C 1.578 2.048 0 O-C-N 120.886 -1.134 . . . . 0.0 112.723 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.407 ' H ' ' HE2' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -137.12 113.6 10.14 Favored 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 102.155 -3.276 . . . . 0.0 102.155 172.771 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 60.8 m -54.4 148.55 23.74 Favored Pre-proline 0 CA--C 1.587 2.387 0 N-CA-C 115.008 1.485 . . . . 0.0 115.008 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -64.74 169.06 12.12 Favored 'Trans proline' 0 CA--C 1.568 2.206 0 C-N-CA 122.384 2.056 . . . . 0.0 116.602 -173.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 83.8 m -67.72 154.03 42.41 Favored 'General case' 0 CA--C 1.572 1.824 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 -178.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.86 173.99 2.07 Favored 'General case' 0 CA--C 1.579 2.081 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -62.65 108.1 1.09 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.551 -1.343 . . . . 0.0 112.363 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 112.1 -22.51 18.21 Favored Glycine 0 N--CA 1.497 2.743 0 N-CA-C 117.749 1.859 . . . . 0.0 117.749 -173.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.9 mp -98.9 152.21 20.01 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-N 119.064 1.432 . . . . 0.0 112.531 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.3 159.49 15.21 Favored 'General case' 0 CA--C 1.564 1.487 0 CA-C-O 122.508 1.147 . . . . 0.0 112.556 177.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 4.9 t -89.44 96.54 10.75 Favored 'General case' 0 CA--C 1.573 1.845 0 N-CA-C 105.95 -1.87 . . . . 0.0 105.95 172.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 . . . . . 0 N--CA 1.495 1.812 0 O-C-N 120.69 -1.256 . . . . 0.0 114.374 -171.103 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.7 m-30 . . . . . 0 N--CA 1.499 2.006 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -94.25 -162.75 35.54 Favored Glycine 0 N--CA 1.488 2.15 0 CA-C-N 115.083 -0.962 . . . . 0.0 113.752 173.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.1 mm -135.53 142.74 38.65 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.009 0 O-C-N 121.761 -0.846 . . . . 0.0 110.537 -176.319 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.566 ' SG ' ' HB2' ' A' ' 49' ' ' CYS . 19.3 m -70.79 130.31 41.36 Favored 'General case' 0 CA--C 1.569 1.709 0 O-C-N 120.169 -1.582 . . . . 0.0 113.375 173.059 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -143.33 155.07 44.35 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 123.228 1.49 . . . . 0.0 112.439 175.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -97.95 73.99 2.29 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 122.794 1.283 . . . . 0.0 111.617 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.501 2.124 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -179.492 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 . . . . . 0 N--CA 1.495 1.784 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.4 tp -150.23 115.33 5.38 Favored 'General case' 0 CA--C 1.577 1.998 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 173.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -75.55 162.31 28.4 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 115.845 1.795 . . . . 0.0 115.845 -172.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.91 140.86 56.38 Favored 'General case' 0 CA--C 1.574 1.869 0 CA-C-O 122.481 1.134 . . . . 0.0 113.809 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.91 2.35 61.12 Favored Glycine 0 N--CA 1.496 2.659 0 N-CA-C 117.856 1.902 . . . . 0.0 117.856 -174.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -112.42 133.04 54.72 Favored 'General case' 0 CA--C 1.566 1.565 0 CA-C-N 118.935 1.367 . . . . 0.0 110.082 -175.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.9 tt -68.33 119.86 13.52 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.424 -0.797 . . . . 0.0 111.834 -176.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 24.7 p -128.07 158.42 38.01 Favored 'General case' 0 CA--C 1.558 1.268 0 CA-C-O 122.35 1.072 . . . . 0.0 112.798 -175.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.8 mt -92.98 -73.67 0.55 Allowed 'General case' 0 CA--C 1.568 1.664 0 O-C-N 120.835 -1.166 . . . . 0.0 108.61 173.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -91.94 150.75 20.85 Favored 'General case' 0 CA--C 1.569 1.674 0 N-CA-C 115.822 1.786 . . . . 0.0 115.822 178.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.1 m -68.56 -16.51 63.89 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 124.93 1.292 . . . . 0.0 114.162 170.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . 0.325 . . -75.03 28.64 0.09 Allowed 'General case' 0 CA--C 1.594 2.645 0 C-N-CA 126.608 1.963 . . . . 0.0 114.036 171.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -138.52 -39.52 0.52 Allowed 'General case' 0 CA--C 1.583 2.217 0 C-N-CA 127.731 2.413 . . . . 0.0 113.126 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.9 m -65.18 -171.67 0.08 Allowed 'General case' 0 CA--C 1.587 2.388 0 CA-C-N 121.817 2.099 . . . . 0.0 115.201 -177.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -70.12 -57.63 4.73 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 119.101 -2.249 . . . . 0.0 115.225 -175.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 36.3 m -82.37 -78.87 0.19 Allowed 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 173.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -174.49 68.95 0.03 OUTLIER 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 173.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.3 t -151.87 94.24 1.95 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 118.885 -2.385 . . . . 0.0 116.553 -174.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 26.3 t -95.63 112.61 24.29 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 101.283 -3.599 . . . . 0.0 101.283 168.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -91.7 124.06 35.56 Favored 'General case' 0 CA--C 1.562 1.421 0 CA-C-O 122.548 1.166 . . . . 0.0 113.786 -171.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.431 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.7 t60 -79.27 131.96 36.32 Favored 'General case' 0 CA--C 1.56 1.361 0 C-N-CA 125.098 1.359 . . . . 0.0 112.031 -174.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.83 31.29 0.09 Allowed 'General case' 0 CA--C 1.585 2.293 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.253 24.9 p 70.31 100.69 0.06 Allowed 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 126.47 1.908 . . . . 0.0 112.096 179.101 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.29 3.7 mp 72.83 -63.66 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 C-N-CA 125.477 1.511 . . . . 0.0 111.614 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.7 tp -68.26 128.89 38.21 Favored 'General case' 0 CA--C 1.571 1.755 0 CA-C-N 120.624 1.556 . . . . 0.0 110.776 174.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.9 p -86.65 31.5 0.68 Allowed 'General case' 0 CA--C 1.571 1.782 0 N-CA-C 118.954 2.946 . . . . 0.0 118.954 -173.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 31.3 tp -82.42 93.61 7.25 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 172.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.1 m -97.35 148.93 22.66 Favored 'General case' 0 CA--C 1.566 1.56 0 CA-C-O 123.325 1.536 . . . . 0.0 114.022 -170.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 57.2 ttm-85 -141.2 137.2 32.47 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.197 -0.939 . . . . 0.0 109.676 -176.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 58.7 m -61.07 140.09 57.94 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 119.632 -1.917 . . . . 0.0 111.896 175.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.69 178.12 7.46 Favored 'General case' 0 CA--C 1.565 1.548 0 N-CA-C 116.492 2.034 . . . . 0.0 116.492 -172.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.8 tp -86.77 149.6 24.75 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-O 122.26 1.029 . . . . 0.0 112.248 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -67.12 141.1 57.54 Favored 'General case' 0 CA--C 1.572 1.793 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 174.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.412 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . . . -75.73 162.12 28.48 Favored 'General case' 0 CA--C 1.571 1.774 0 CA-C-O 124.181 1.943 . . . . 0.0 115.173 -176.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -111.09 -178.81 3.56 Favored 'General case' 0 CA--C 1.567 1.61 0 CA-C-N 113.397 -1.729 . . . . 0.0 113.082 -173.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -60.0 135.34 57.68 Favored 'General case' 0 CA--C 1.568 1.648 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -176.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 66.72 38.14 4.0 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 124.902 1.281 . . . . 0.0 113.307 -173.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 10.9 t -128.19 140.36 51.95 Favored 'General case' 0 CA--C 1.561 1.391 0 O-C-N 121.011 -1.055 . . . . 0.0 111.991 178.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -73.06 97.05 2.27 Favored 'General case' 0 CA--C 1.572 1.793 0 C-N-CA 124.13 0.972 . . . . 0.0 112.226 178.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.16 136.48 36.57 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-O 122.117 0.961 . . . . 0.0 112.057 177.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 91.8 p -88.06 116.12 26.02 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 105.226 -2.139 . . . . 0.0 105.226 171.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -80.02 -117.9 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.964 0 CA-C-O 116.219 -1.848 . . . . 0.0 114.583 -172.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -130.42 154.0 48.18 Favored 'General case' 0 CA--C 1.567 1.6 1 N-CA-C 123.486 4.625 . . . . 0.0 123.486 -170.165 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.434 24.0 p 43.29 122.15 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.258 0 CA-C-N 108.4 -4.0 . . . . 0.0 116.378 -172.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.775 HD23 ' H ' ' A' ' 56' ' ' GLY 0.418 0.0 OUTLIER -145.54 -71.55 0.26 Allowed 'General case' 0 CA--C 1.576 1.946 1 CA-C-N 107.695 -4.32 . . . . 0.0 102.142 -173.309 . . . . . . . . 5 4 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.626 ' H ' HD23 ' A' ' 54' ' ' LEU . 52.6 t80 -158.99 -30.77 0.07 Allowed 'General case' 0 CA--C 1.591 2.55 0 C-N-CA 127.694 2.398 . . . . 0.0 110.474 171.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.775 ' H ' HD23 ' A' ' 54' ' ' LEU . . . 122.93 43.82 0.35 Allowed Glycine 0 CA--C 1.556 2.605 0 N-CA-C 117.436 1.735 . . . . 0.0 117.436 -172.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.431 HG12 ' HB2' ' A' ' 30' ' ' HIS . 11.3 t -138.84 132.68 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.422 0 CA-C-N 122.958 3.379 . . . . 0.0 106.428 145.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -117.84 132.11 56.48 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.744 -172.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -61.97 -42.62 99.33 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 120.038 -1.663 . . . . 0.0 115.402 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -142.76 119.27 11.0 Favored 'General case' 0 CA--C 1.562 1.408 0 N-CA-C 105.277 -2.12 . . . . 0.0 105.277 174.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 84.2 m -44.17 148.95 0.75 Allowed Pre-proline 0 CA--C 1.593 2.607 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 -176.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -70.05 42.23 0.36 Allowed 'Trans proline' 0 CA--C 1.574 2.519 1 N-CA-C 122.521 4.008 . . . . 0.0 122.521 -171.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.412 ' SG ' ' HB3' ' A' ' 43' ' ' ALA . 67.6 m 58.98 154.13 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 117.516 2.413 . . . . 0.0 117.516 175.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -62.27 151.83 35.31 Favored 'General case' 0 CA--C 1.573 1.837 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -179.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -68.98 104.08 2.0 Favored 'General case' 0 CA--C 1.573 1.84 0 CA-C-O 122.38 1.086 . . . . 0.0 112.324 -174.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 136.44 -29.49 2.79 Favored Glycine 0 N--CA 1.497 2.742 0 N-CA-C 116.108 1.203 . . . . 0.0 116.108 -173.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.5 mp -96.88 144.6 26.67 Favored 'General case' 0 CA--C 1.566 1.567 0 C-N-CA 124.372 1.069 . . . . 0.0 111.538 177.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -99.43 135.77 40.36 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 122.012 0.911 . . . . 0.0 111.567 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 30.3 t -94.99 113.89 25.64 Favored 'General case' 0 CA--C 1.568 1.641 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.669 175.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 N--CA 1.501 2.095 0 O-C-N 120.122 -1.611 . . . . 0.0 113.319 -174.317 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 . . . . . 0 N--CA 1.5 2.026 0 CA-C-O 122.726 1.25 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -73.6 135.61 20.9 Favored Glycine 0 N--CA 1.487 2.048 0 N-CA-C 116.645 1.418 . . . . 0.0 116.645 -179.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.6 mm -89.76 134.15 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 CA-C-O 122.743 1.259 . . . . 0.0 109.047 -174.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 69.6 m -80.81 122.42 27.16 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -132.79 153.02 51.65 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 122.733 1.254 . . . . 0.0 110.701 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -93.61 127.14 39.14 Favored 'General case' 0 CA--C 1.56 1.36 0 CA-C-O 122.834 1.302 . . . . 0.0 110.617 -174.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.4 p . . . . . 0 N--CA 1.494 1.763 0 CA-C-N 114.124 -1.398 . . . . 0.0 113.422 -173.684 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.253 69.3 m-80 . . . . . 0 N--CA 1.505 2.312 0 CA-C-O 122.441 1.115 . . . . 0.0 111.308 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.4 ' H ' ' HA ' ' A' ' 23' ' ' CYS . 1.7 pt? -141.75 164.3 30.56 Favored 'General case' 0 CA--C 1.577 2.011 0 CA-C-O 122.519 1.152 . . . . 0.0 111.491 173.746 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -80.14 167.34 20.48 Favored 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 116.291 1.96 . . . . 0.0 116.291 -173.231 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -72.03 138.91 48.25 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.433 0.693 . . . . 0.0 110.418 175.005 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 92.83 5.84 64.14 Favored Glycine 0 CA--C 1.558 2.766 0 N-CA-C 116.23 1.252 . . . . 0.0 116.23 -172.149 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -109.09 144.38 37.2 Favored 'General case' 0 CA--C 1.567 1.611 0 CA-C-N 119.002 1.401 . . . . 0.0 109.925 174.475 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 tt -67.4 115.45 7.06 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -174.744 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.5 p -110.91 152.82 26.3 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 124.359 1.063 . . . . 0.0 113.264 179.411 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.3 mt -84.54 -78.69 0.24 Allowed 'General case' 0 CA--C 1.568 1.657 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 174.127 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -96.09 177.85 5.6 Favored 'General case' 0 CA--C 1.578 2.052 0 O-C-N 121.202 -0.936 . . . . 0.0 113.191 172.795 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.1 m -77.37 -19.37 56.32 Favored 'General case' 0 N--CA 1.504 2.25 0 N-CA-C 116.48 2.03 . . . . 0.0 116.48 174.894 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.32 17.71 0.47 Allowed 'General case' 0 CA--C 1.581 2.164 0 N-CA-C 116.655 2.095 . . . . 0.0 116.655 173.939 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -96.9 -48.87 5.26 Favored 'General case' 0 CA--C 1.57 1.723 0 C-N-CA 125.127 1.371 . . . . 0.0 114.1 -177.194 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.4 ' HA ' ' H ' ' A' ' 11' ' ' LEU . 87.9 m -81.19 170.63 15.89 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 115.965 1.839 . . . . 0.0 115.965 -177.4 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -63.06 -55.83 22.15 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 123.561 0.745 . . . . 0.0 109.283 171.531 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.4 t -82.56 100.4 10.1 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 104.166 -2.531 . . . . 0.0 104.166 169.077 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -72.67 71.86 1.01 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 125.081 2.372 . . . . 0.0 114.39 -173.642 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.411 ' SG ' ' HB3' ' A' ' 40' ' ' ALA . 2.1 t -148.02 86.19 1.56 Allowed 'General case' 0 CA--C 1.559 1.316 0 CA-C-N 112.373 -2.194 . . . . 0.0 109.513 -173.531 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.7 t -80.66 119.5 23.37 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 120.586 -1.321 . . . . 0.0 107.908 173.857 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.9 tp60 -101.42 117.51 35.08 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.542 1.137 . . . . 0.0 113.22 -172.96 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 8.4 m170 -60.73 159.59 10.69 Favored 'General case' 0 CA--C 1.567 1.603 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 177.162 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -89.91 60.37 4.92 Favored 'General case' 0 CA--C 1.578 2.04 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 171.126 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.7 m 80.96 -75.3 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.191 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 -169.06 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.0 mt -138.2 -115.25 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.584 2.253 0 N-CA-C 103.502 -2.777 . . . . 0.0 103.502 172.535 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.251 3.8 mm? 41.59 -107.89 0.09 Allowed 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 127.123 2.169 . . . . 0.0 114.806 174.56 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 89.8 p -152.1 -111.3 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.315 0 CA-C-O 116.133 -1.889 . . . . 0.0 109.709 173.27 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.0 tp 23.24 60.97 0.04 OUTLIER 'General case' 0 N--CA 1.514 2.761 0 CA-C-N 121.362 1.892 . . . . 0.0 115.683 -174.35 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 45.2 m -99.17 119.15 37.39 Favored 'General case' 0 CA--C 1.554 1.098 0 CA-C-N 114.257 -1.338 . . . . 0.0 112.298 -170.664 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -99.11 165.65 11.62 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.961 -0.462 . . . . 0.0 110.469 175.083 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 45.9 m -80.59 152.16 28.71 Favored 'General case' 0 CA--C 1.563 1.475 0 O-C-N 119.064 -2.272 . . . . 0.0 112.12 173.447 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.411 ' HB3' ' SG ' ' A' ' 27' ' ' CYS . . . -140.66 -178.76 5.67 Favored 'General case' 0 CA--C 1.569 1.675 0 CA-C-N 113.282 -1.781 . . . . 0.0 112.689 -173.915 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -88.42 137.32 32.43 Favored 'General case' 0 CA--C 1.568 1.642 0 O-C-N 121.01 -1.056 . . . . 0.0 112.571 179.629 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.97 155.42 30.8 Favored 'General case' 0 CA--C 1.576 1.979 0 CA-C-O 121.868 0.842 . . . . 0.0 110.709 172.422 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.53 156.43 27.77 Favored 'General case' 0 CA--C 1.568 1.642 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 -173.634 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 22.7 mtm180 -129.29 172.93 10.99 Favored 'General case' 0 CA--C 1.563 1.47 0 CA-C-N 112.806 -1.997 . . . . 0.0 109.761 177.558 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -48.77 130.45 17.73 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 115.62 1.711 . . . . 0.0 115.62 -173.891 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.8 m120 77.19 10.24 2.52 Favored 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 -174.182 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 30.7 t -109.26 148.75 30.48 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 120.532 1.514 . . . . 0.0 112.268 175.277 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -79.76 112.56 17.16 Favored 'General case' 0 CA--C 1.57 1.744 0 CA-C-O 123.839 1.781 . . . . 0.0 112.747 -178.346 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.97 177.4 5.44 Favored 'General case' 0 CA--C 1.571 1.772 0 CA-C-N 112.304 -2.225 . . . . 0.0 111.048 173.639 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.432 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 58.3 m -79.65 -113.03 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 104.872 -2.27 . . . . 0.0 104.872 170.017 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -160.17 -80.53 0.05 OUTLIER 'General case' 0 CA--C 1.564 1.486 0 CA-C-N 122.862 2.573 . . . . 0.0 110.788 172.272 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -77.63 -46.34 22.36 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 174.743 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.9 p 60.74 153.62 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 124.954 2.312 . . . . 0.0 116.447 -176.858 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.53 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.6 pt? -97.59 179.45 4.84 Favored 'General case' 0 CA--C 1.583 2.234 0 CA-C-N 112.71 -2.041 . . . . 0.0 108.685 171.985 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -84.76 12.84 6.54 Favored 'General case' 0 N--CA 1.514 2.743 0 O-C-N 118.422 -2.674 . . . . 0.0 114.036 174.009 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.45 ' H ' ' HG ' ' A' ' 54' ' ' LEU . . . -113.41 -152.42 11.0 Favored Glycine 0 N--CA 1.476 1.357 0 O-C-N 120.99 -1.069 . . . . 0.0 114.226 -173.831 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.5 t -78.49 142.08 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 CA-C-O 122.912 1.339 . . . . 0.0 111.314 -167.442 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -119.51 153.61 35.09 Favored 'General case' 0 CA--C 1.561 1.393 0 N-CA-C 116.468 2.025 . . . . 0.0 116.468 -171.329 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -83.03 -56.08 4.0 Favored 'General case' 0 CA--C 1.577 2.016 0 CA-C-N 113.253 -1.794 . . . . 0.0 110.077 172.964 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -133.16 108.01 8.54 Favored 'General case' 0 CA--C 1.564 1.505 0 N-CA-C 104.606 -2.368 . . . . 0.0 104.606 173.448 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.6 m -52.11 153.06 5.08 Favored Pre-proline 0 CA--C 1.584 2.259 0 N-CA-C 118.433 2.753 . . . . 0.0 118.433 -175.333 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -70.31 172.29 13.45 Favored 'Trans proline' 0 CA--C 1.568 2.204 0 C-N-CA 122.687 2.258 . . . . 0.0 115.574 -177.904 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 60.4 m -70.77 156.39 39.58 Favored 'General case' 0 CA--C 1.571 1.754 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 177.312 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.53 168.55 3.56 Favored 'General case' 0 CA--C 1.58 2.099 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 174.793 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 91.5 mtt180 -63.03 112.16 2.48 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.227 -1.546 . . . . 0.0 113.492 -175.52 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 114.42 -22.83 13.0 Favored Glycine 0 N--CA 1.495 2.622 0 N-CA-C 118.926 2.33 . . . . 0.0 118.926 -173.984 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.7 mp -99.43 143.76 29.31 Favored 'General case' 0 CA--C 1.572 1.792 0 CA-C-N 119.462 1.631 . . . . 0.0 112.877 -176.02 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -102.23 155.44 18.22 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 124.116 0.967 . . . . 0.0 113.413 -177.308 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.432 ' SG ' ' O ' ' A' ' 50' ' ' SER . 1.9 t -94.67 83.71 4.12 Favored 'General case' 0 CA--C 1.579 2.079 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 179.684 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 . . . . . 0 N--CA 1.497 1.893 0 O-C-N 120.476 -1.39 . . . . 0.0 112.034 -176.703 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.9 m-30 . . . . . 0 N--CA 1.497 1.9 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -160.55 167.31 35.69 Favored Glycine 0 CA--C 1.556 2.61 0 C-N-CA 124.895 1.236 . . . . 0.0 112.866 -179.573 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.5 mm -98.35 134.14 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.519 0 O-C-N 119.582 -2.128 . . . . 0.0 110.436 -179.388 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 94.9 m -63.21 123.83 19.64 Favored 'General case' 0 CA--C 1.572 1.792 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 174.662 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 79.0 m-70 -144.33 155.48 43.83 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-O 122.553 1.168 . . . . 0.0 111.613 175.57 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 40.0 t-20 -96.71 122.92 40.18 Favored 'General case' 0 CA--C 1.566 1.594 0 O-C-N 120.892 -1.13 . . . . 0.0 110.354 179.433 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 N--CA 1.498 1.96 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 -174.964 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.307 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.205 0 N-CA-C 116.656 2.095 . . . . 0.0 116.656 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 tp -132.34 120.49 22.14 Favored 'General case' 0 CA--C 1.569 1.707 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 -174.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -81.78 173.55 12.18 Favored 'General case' 0 CA--C 1.569 1.693 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 -172.659 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -56.37 137.87 51.94 Favored 'General case' 0 CA--C 1.568 1.652 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 176.787 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.8 -17.49 27.6 Favored Glycine 0 N--CA 1.497 2.734 0 N-CA-C 118.122 2.009 . . . . 0.0 118.122 -177.162 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -100.3 145.56 27.99 Favored 'General case' 0 CA--C 1.564 1.503 0 CA-C-N 118.428 1.114 . . . . 0.0 112.216 -177.251 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 72.6 mt -77.9 137.55 38.42 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 122.08 0.943 . . . . 0.0 113.119 -179.634 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.6 p -138.62 149.65 45.44 Favored 'General case' 0 CA--C 1.562 1.417 0 CA-C-O 122.073 0.939 . . . . 0.0 112.827 -174.567 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 98.7 mt -84.38 -74.04 0.4 Allowed 'General case' 0 CA--C 1.567 1.616 0 O-C-N 121.424 -0.797 . . . . 0.0 109.126 174.434 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.8 p30 -95.06 173.58 7.51 Favored 'General case' 0 CA--C 1.577 1.984 0 CA-C-N 120.111 1.323 . . . . 0.0 113.473 172.846 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.8 m -78.69 -19.27 52.86 Favored 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 116.994 2.22 . . . . 0.0 116.994 174.923 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.72 31.62 0.16 Allowed 'General case' 0 CA--C 1.579 2.083 0 N-CA-C 116.685 2.105 . . . . 0.0 116.685 174.342 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -114.72 -34.77 5.05 Favored 'General case' 0 CA--C 1.576 1.977 0 C-N-CA 126.414 1.886 . . . . 0.0 113.003 174.393 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . 0.273 67.3 m -80.67 -133.82 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.909 0 CA-C-N 120.87 1.668 . . . . 0.0 114.533 -174.983 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.3 -77.43 0.19 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 119.238 -2.164 . . . . 0.0 112.378 -173.777 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 77.4 p -88.33 -63.86 1.23 Allowed 'General case' 0 CA--C 1.568 1.653 0 CA-C-O 122.547 1.165 . . . . 0.0 110.481 173.09 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -169.66 81.78 0.12 Allowed 'General case' 0 CA--C 1.568 1.665 0 N-CA-C 103.991 -2.596 . . . . 0.0 103.991 177.416 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 53.5 t -140.85 62.98 1.47 Allowed 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 118.634 2.827 . . . . 0.0 118.634 -171.71 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 22.7 t -93.39 116.68 29.23 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 170.796 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.31 118.42 36.85 Favored 'General case' 0 CA--C 1.57 1.718 0 CA-C-O 122.663 1.221 . . . . 0.0 113.716 -172.367 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.517 ' HB2' HG12 ' A' ' 57' ' ' VAL . 5.6 t-160 -84.13 125.09 31.83 Favored 'General case' 0 CA--C 1.564 1.491 0 C-N-CA 124.921 1.289 . . . . 0.0 111.184 -178.025 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . 0.3 0.3 OUTLIER -83.41 57.64 4.12 Favored 'General case' 0 CA--C 1.58 2.117 0 O-C-N 120.735 -1.228 . . . . 0.0 114.252 175.191 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.351 18.3 p 90.83 178.77 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.756 0 C-N-CA 127.13 2.172 . . . . 0.0 112.354 -174.897 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 14.8 mm -59.86 -62.45 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 119.616 -1.928 . . . . 0.0 115.282 -172.695 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.5 tp -92.62 79.93 4.82 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-N 120.184 1.356 . . . . 0.0 108.863 174.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.3 p -145.96 172.23 13.67 Favored 'General case' 0 CA--C 1.568 1.67 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 -173.194 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 39.9 tp -88.16 140.08 29.85 Favored 'General case' 0 CA--C 1.574 1.865 0 CA-C-O 121.682 0.753 . . . . 0.0 111.507 174.514 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.5 m -104.61 110.92 23.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.951 -1.093 . . . . 0.0 112.063 -175.024 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.5 ttp180 -121.12 142.02 50.26 Favored 'General case' 0 CA--C 1.567 1.629 0 C-N-CA 124.21 1.004 . . . . 0.0 109.758 178.615 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 55.2 m -69.81 150.78 46.49 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-O 124.776 2.227 . . . . 0.0 114.323 179.03 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -132.39 -178.39 4.9 Favored 'General case' 0 CA--C 1.562 1.442 0 CA-C-N 111.774 -2.466 . . . . 0.0 113.111 -174.18 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.1 mt -84.89 138.19 32.68 Favored 'General case' 0 CA--C 1.567 1.597 0 O-C-N 121.242 -0.911 . . . . 0.0 111.742 177.75 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -68.4 139.64 55.8 Favored 'General case' 0 CA--C 1.576 1.945 0 O-C-N 121.56 -0.712 . . . . 0.0 111.065 173.841 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.39 151.31 39.72 Favored 'General case' 0 CA--C 1.57 1.712 0 N-CA-C 118.122 2.638 . . . . 0.0 118.122 -171.359 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 50.5 mtp180 -104.1 168.95 8.78 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 112.809 -1.996 . . . . 0.0 111.866 -178.903 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -52.77 126.68 20.81 Favored 'General case' 0 CA--C 1.573 1.837 0 N-CA-C 114.222 1.194 . . . . 0.0 114.222 -174.915 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 71.66 32.65 1.95 Allowed 'General case' 0 N--CA 1.503 2.214 0 C-N-CA 125.132 1.373 . . . . 0.0 113.599 -172.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.7 m -130.24 153.49 48.55 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.685 -1.26 . . . . 0.0 111.033 174.83 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -69.98 136.1 50.1 Favored 'General case' 0 CA--C 1.574 1.882 0 CA-C-O 124.002 1.858 . . . . 0.0 114.412 -176.177 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.434 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 26.7 p -138.93 148.25 43.32 Favored 'General case' 0 CA--C 1.566 1.593 0 CA-C-N 112.563 -2.108 . . . . 0.0 111.496 -178.372 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.3 m -78.25 107.76 11.09 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.277 -1.514 . . . . 0.0 108.253 174.299 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.34 -40.14 62.36 Favored 'General case' 0 CA--C 1.57 1.718 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -174.618 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -86.36 145.65 26.8 Favored 'General case' 0 CA--C 1.571 1.781 0 C-N-CA 124.344 1.058 . . . . 0.0 109.202 172.278 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.7 p -123.93 145.7 48.96 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-O 123.796 1.76 . . . . 0.0 109.867 173.406 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.264 0.6 OUTLIER -109.1 -135.25 0.35 Allowed 'General case' 0 CA--C 1.565 1.55 0 CA-C-N 113.404 -1.725 . . . . 0.0 106.668 174.551 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -130.95 71.34 1.47 Allowed 'General case' 0 CA--C 1.569 1.69 0 N-CA-C 104.023 -2.584 . . . . 0.0 104.023 170.178 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 169.74 -159.72 32.52 Favored Glycine 0 N--CA 1.486 1.968 0 N-CA-C 117.125 1.61 . . . . 0.0 117.125 -174.177 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.517 HG12 ' HB2' ' A' ' 30' ' ' HIS . 5.2 t -79.19 146.92 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.99 0 CA-C-O 122.343 1.068 . . . . 0.0 112.277 -166.801 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -123.87 158.41 31.95 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -173.153 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -86.16 -21.91 27.3 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 174.373 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -146.37 122.8 11.01 Favored 'General case' 0 CA--C 1.564 1.519 0 N-CA-C 105.507 -2.035 . . . . 0.0 105.507 177.826 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.473 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 56.9 m -58.91 134.05 87.07 Favored Pre-proline 0 CA--C 1.597 2.775 0 O-C-N 119.888 -1.758 . . . . 0.0 115.27 -179.907 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 61' ' ' CYS . 36.5 Cg_exo -66.76 64.77 0.56 Allowed 'Trans proline' 0 CA--C 1.581 2.825 0 N-CA-C 121.307 3.541 . . . . 0.0 121.307 -174.064 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 69.1 m 58.53 164.0 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 175.838 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -79.21 166.27 22.36 Favored 'General case' 0 CA--C 1.576 1.977 0 O-C-N 120.64 -1.287 . . . . 0.0 113.934 174.287 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -63.43 115.29 4.49 Favored 'General case' 0 CA--C 1.573 1.864 0 O-C-N 120.965 -1.085 . . . . 0.0 113.612 -178.05 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 107.31 -17.99 36.46 Favored Glycine 0 N--CA 1.5 2.931 0 N-CA-C 118.311 2.084 . . . . 0.0 118.311 -174.193 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.1 mp -98.04 151.81 19.94 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-N 118.584 1.192 . . . . 0.0 111.638 179.049 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -100.26 149.87 23.14 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.835 -1.166 . . . . 0.0 112.192 175.982 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 11.8 t -92.6 120.03 32.64 Favored 'General case' 0 CA--C 1.567 1.634 0 CA-C-N 115.07 -0.968 . . . . 0.0 108.892 172.924 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 . . . . . 0 N--CA 1.492 1.654 0 O-C-N 120.748 -1.22 . . . . 0.0 110.991 -174.031 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 122.426 1.107 . . . . 0.0 112.212 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.39 157.57 51.64 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 115.717 1.047 . . . . 0.0 115.717 177.314 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 33.3 mm -104.52 140.41 22.66 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 121.22 -1.165 . . . . 0.0 110.925 -172.224 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.434 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 89.6 m -72.22 122.92 21.87 Favored 'General case' 0 CA--C 1.566 1.561 0 O-C-N 120.567 -1.333 . . . . 0.0 113.465 174.637 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -133.55 151.36 51.72 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.825 -1.172 . . . . 0.0 110.393 176.296 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -94.36 127.3 40.16 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 122.517 1.151 . . . . 0.0 111.271 -174.374 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 N--CA 1.501 2.09 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 -173.97 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 . . . . . 0 N--CA 1.5 2.045 0 N-CA-C 117.495 2.406 . . . . 0.0 117.495 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . 0.25 28.3 tp -110.13 133.78 52.87 Favored 'General case' 0 CA--C 1.581 2.136 0 O-C-N 120.665 -1.272 . . . . 0.0 109.392 174.42 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -77.18 160.5 28.91 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 119.509 -1.995 . . . . 0.0 115.369 -173.934 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.38 128.25 34.98 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 122.215 1.007 . . . . 0.0 109.855 173.409 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 96.89 24.37 13.32 Favored Glycine 0 CA--C 1.557 2.663 0 N-CA-C 116.423 1.329 . . . . 0.0 116.423 -172.967 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -129.27 139.25 51.87 Favored 'General case' 0 CA--C 1.567 1.63 0 CA-C-N 118.533 1.167 . . . . 0.0 109.427 177.638 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.8 mp -65.7 128.74 37.18 Favored 'General case' 0 CA--C 1.574 1.891 0 O-C-N 120.919 -1.113 . . . . 0.0 112.746 -178.063 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.0 p -129.16 154.09 47.08 Favored 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 -174.313 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.4 mt -85.46 -76.82 0.31 Allowed 'General case' 0 CA--C 1.568 1.64 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 173.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.8 p30 -97.35 172.92 7.47 Favored 'General case' 0 CA--C 1.577 2.002 0 CA-C-N 120.003 1.274 . . . . 0.0 113.747 172.915 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.6 m -77.75 -20.63 53.1 Favored 'General case' 0 N--CA 1.505 2.28 0 N-CA-C 116.956 2.206 . . . . 0.0 116.956 175.001 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.58 10.74 1.56 Allowed 'General case' 0 CA--C 1.575 1.928 0 N-CA-C 117.292 2.33 . . . . 0.0 117.292 174.951 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -97.17 -29.28 13.68 Favored 'General case' 0 CA--C 1.576 1.964 0 C-N-CA 125.152 1.381 . . . . 0.0 114.224 173.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 5.3 m -80.78 159.31 25.19 Favored 'General case' 0 CA--C 1.574 1.87 0 N-CA-C 115.081 1.511 . . . . 0.0 115.081 -179.521 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.7 mptt -63.51 -57.31 10.59 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 120.843 -1.161 . . . . 0.0 108.906 170.717 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.8 t -82.02 104.19 12.2 Favored 'General case' 0 CA--C 1.565 1.548 0 N-CA-C 104.537 -2.394 . . . . 0.0 104.537 170.166 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -68.59 82.31 0.27 Allowed 'General case' 0 N--CA 1.5 2.056 0 CA-C-O 124.411 2.053 . . . . 0.0 113.445 -172.89 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 49.7 t -160.7 87.17 0.74 Allowed 'General case' 0 CA--C 1.558 1.272 0 CA-C-N 112.499 -2.137 . . . . 0.0 111.421 -177.284 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 37.1 t -79.16 110.7 14.67 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 102.911 -2.996 . . . . 0.0 102.911 170.557 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.69 112.82 24.9 Favored 'General case' 0 CA--C 1.557 1.218 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -170.384 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.545 ' HB2' HG12 ' A' ' 57' ' ' VAL . 15.6 t-80 -81.02 141.18 34.65 Favored 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 124.822 1.249 . . . . 0.0 113.126 -175.702 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.2 p-10 -69.45 17.32 0.05 OUTLIER 'General case' 0 CA--C 1.591 2.558 0 N-CA-C 117.753 2.501 . . . . 0.0 117.753 172.412 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.275 43.0 p 74.75 97.59 0.07 Allowed 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 127.216 2.206 . . . . 0.0 112.402 176.683 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.276 37.3 mm 75.12 -49.98 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.387 0 C-N-CA 125.464 1.506 . . . . 0.0 115.014 174.775 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.258 0.5 OUTLIER -76.9 -121.82 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.143 0 CA-C-N 122.551 2.432 . . . . 0.0 112.965 -179.223 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 82.9 p -159.72 102.09 1.5 Allowed 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 123.943 3.065 . . . . 0.0 117.167 179.964 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 tt -164.39 105.76 0.87 Allowed 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 102.802 -3.036 . . . . 0.0 102.802 173.307 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.6 m -121.13 122.7 40.58 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.865 0.84 . . . . 0.0 112.313 -173.666 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -138.22 136.38 36.52 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 123.94 0.896 . . . . 0.0 110.627 -174.312 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 67.1 m -61.5 146.26 49.18 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 119.906 -1.746 . . . . 0.0 114.839 -177.48 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -142.74 169.58 17.3 Favored 'General case' 0 CA--C 1.567 1.601 0 CA-C-O 123.663 1.697 . . . . 0.0 115.028 -174.514 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.43 ' H ' HD23 ' A' ' 41' ' ' LEU . 2.5 pt? -91.07 167.9 12.03 Favored 'General case' 0 CA--C 1.573 1.835 0 CA-C-N 114.329 -1.305 . . . . 0.0 111.459 173.89 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.9 158.5 25.08 Favored 'General case' 0 CA--C 1.584 2.27 0 O-C-N 120.344 -1.472 . . . . 0.0 113.467 174.492 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.49 166.94 22.68 Favored 'General case' 0 CA--C 1.572 1.822 0 O-C-N 120.236 -1.54 . . . . 0.0 113.161 177.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -96.54 163.11 13.17 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.553 -1.342 . . . . 0.0 112.895 -174.408 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -63.89 129.08 38.62 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.337 0.589 . . . . 0.0 111.083 177.364 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 79.81 14.95 0.9 Allowed 'General case' 0 N--CA 1.509 2.477 0 C-N-CA 125.069 1.348 . . . . 0.0 113.758 -171.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 27.2 t -113.88 160.14 19.09 Favored 'General case' 0 CA--C 1.566 1.578 0 O-C-N 120.385 -1.447 . . . . 0.0 111.887 174.73 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 65.8 mt-10 -70.85 116.81 11.58 Favored 'General case' 0 CA--C 1.571 1.771 0 CA-C-O 122.925 1.345 . . . . 0.0 113.729 -175.69 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.446 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 15.5 p -124.04 160.5 27.55 Favored 'General case' 0 CA--C 1.568 1.644 0 CA-C-N 113.987 -1.461 . . . . 0.0 113.812 177.766 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.6 t -134.22 123.81 24.92 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 105.363 -2.088 . . . . 0.0 105.363 171.775 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.96 62.82 3.49 Favored 'General case' 0 CA--C 1.565 1.557 0 N-CA-C 115.915 1.821 . . . . 0.0 115.915 -173.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.13 141.62 25.38 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 118.742 2.867 . . . . 0.0 118.742 -172.485 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 64.8 p -141.74 147.87 38.09 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 123.396 1.57 . . . . 0.0 108.834 172.201 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -134.59 -124.25 0.16 Allowed 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 174.598 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -132.61 57.97 1.78 Allowed 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 173.476 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -169.93 -172.48 36.49 Favored Glycine 0 N--CA 1.487 2.037 0 N-CA-C 115.584 0.994 . . . . 0.0 115.584 -173.396 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.545 HG12 ' HB2' ' A' ' 30' ' ' HIS . 3.3 t -81.45 143.42 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 CA-C-O 122.233 1.016 . . . . 0.0 111.808 -172.569 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -119.33 139.89 51.22 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-O 121.909 0.862 . . . . 0.0 112.6 -173.36 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -74.64 -6.39 48.39 Favored 'General case' 0 CA--C 1.589 2.478 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 174.181 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.62 127.36 3.17 Favored 'General case' 0 CA--C 1.568 1.64 0 C-N-CA 127.302 2.241 . . . . 0.0 106.454 -174.292 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.0 m -68.29 133.57 91.33 Favored Pre-proline 0 CA--C 1.587 2.374 0 O-C-N 119.705 -1.872 . . . . 0.0 112.537 174.124 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -52.31 -0.72 0.06 OUTLIER 'Trans proline' 0 CA--C 1.57 2.279 1 N-CA-C 123.877 4.53 . . . . 0.0 123.877 -174.761 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 73.37 -40.34 0.46 Allowed 'General case' 0 N--CA 1.503 2.186 0 N-CA-C 119.019 2.97 . . . . 0.0 119.019 174.205 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.269 15.2 pt-20 -89.2 59.53 4.95 Favored 'General case' 0 CA--C 1.555 1.151 1 N-CA-C 125.568 5.396 . . . . 0.0 125.568 -172.118 . . . . . . . . 3 2 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.2 mtm105 -88.68 87.81 7.39 Favored 'General case' 0 N--CA 1.501 2.103 0 N-CA-C 104.959 -2.237 . . . . 0.0 104.959 168.001 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 78.8 25.25 60.65 Favored Glycine 0 CA--C 1.568 3.376 0 N-CA-C 116.705 1.442 . . . . 0.0 116.705 -170.943 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . 0.272 4.9 tt -142.13 -162.37 1.39 Allowed 'General case' 0 CA--C 1.581 2.143 0 C-N-CA 125.346 1.458 . . . . 0.0 109.576 -176.283 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -140.06 138.57 35.48 Favored 'General case' 0 CA--C 1.578 2.052 0 O-C-N 118.688 -2.507 . . . . 0.0 110.744 174.229 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 43.4 t -93.05 123.63 36.44 Favored 'General case' 0 CA--C 1.568 1.64 0 O-C-N 121.261 -0.899 . . . . 0.0 108.602 170.832 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 . . . . . 0 N--CA 1.497 1.881 0 O-C-N 120.138 -1.601 . . . . 0.0 110.378 179.433 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 . . . . . 0 N--CA 1.499 2.016 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -106.17 -165.04 22.99 Favored Glycine 0 N--CA 1.492 2.426 0 C-N-CA 123.572 0.605 . . . . 0.0 113.941 173.547 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 34.0 mm -121.56 142.79 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.251 0 CA-C-O 122.472 1.129 . . . . 0.0 110.429 178.94 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.446 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 82.8 m -67.91 118.09 10.66 Favored 'General case' 0 CA--C 1.57 1.714 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 174.033 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -142.64 139.62 31.32 Favored 'General case' 0 N--CA 1.483 1.175 0 O-C-N 120.548 -1.345 . . . . 0.0 107.879 173.853 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -94.41 70.6 3.7 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 123.949 1.833 . . . . 0.0 112.027 -175.9 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.5 m . . . . . 0 CA--C 1.569 1.691 0 CA-C-N 112.667 -2.061 . . . . 0.0 113.947 -175.265 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 . . . . . 0 CA--C 1.582 2.18 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 pp -128.44 169.22 14.56 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 116.022 1.86 . . . . 0.0 116.022 -174.759 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -75.0 169.77 17.34 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 115.702 1.741 . . . . 0.0 115.702 -173.026 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -75.08 153.36 38.39 Favored 'General case' 0 CA--C 1.575 1.931 0 CA-C-O 122.253 1.025 . . . . 0.0 112.452 176.921 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 92.43 23.29 26.95 Favored Glycine 0 N--CA 1.496 2.643 0 N-CA-C 116.706 1.442 . . . . 0.0 116.706 -173.066 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 -135.62 142.87 45.29 Favored 'General case' 0 CA--C 1.569 1.676 0 C-N-CA 124.773 1.229 . . . . 0.0 110.805 -177.917 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.4 tp -77.9 142.21 38.57 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -174.844 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.9 p -131.88 -178.58 4.95 Favored 'General case' 0 CA--C 1.575 1.936 0 CA-C-O 123.106 1.431 . . . . 0.0 114.601 -176.201 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.9 mt -107.79 -74.59 0.65 Allowed 'General case' 0 CA--C 1.574 1.902 0 N-CA-C 104.851 -2.277 . . . . 0.0 104.851 170.603 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -95.86 -168.59 1.79 Allowed 'General case' 0 CA--C 1.587 2.384 0 CA-C-N 119.986 1.266 . . . . 0.0 113.345 171.758 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.0 m -90.15 -9.47 48.15 Favored 'General case' 0 N--CA 1.507 2.425 0 N-CA-C 117.034 2.235 . . . . 0.0 117.034 174.291 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.73 10.35 2.26 Favored 'General case' 0 CA--C 1.577 2.005 0 N-CA-C 117.395 2.368 . . . . 0.0 117.395 175.24 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -94.2 -29.88 14.88 Favored 'General case' 0 CA--C 1.569 1.693 0 C-N-CA 124.807 1.243 . . . . 0.0 113.821 176.866 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . 0.259 80.4 m -81.99 -172.72 4.09 Favored 'General case' 0 CA--C 1.585 2.314 0 CA-C-N 121.866 2.121 . . . . 0.0 111.382 173.035 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -56.11 -69.87 0.13 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 119.345 -2.097 . . . . 0.0 116.646 -172.014 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.0 t -86.86 -72.51 0.5 Allowed 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 122.053 0.93 . . . . 0.0 111.443 174.315 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -172.17 63.96 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.937 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.63 -174.017 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 37.5 t -139.74 71.84 1.39 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 119.368 -2.082 . . . . 0.0 116.378 -173.731 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.3 t -98.03 123.86 42.25 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 170.637 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -103.23 120.3 40.48 Favored 'General case' 0 CA--C 1.573 1.835 0 CA-C-O 122.956 1.36 . . . . 0.0 114.053 -172.456 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.522 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.1 t60 -86.07 133.37 33.9 Favored 'General case' 0 CA--C 1.562 1.422 0 C-N-CA 125.322 1.449 . . . . 0.0 112.389 -177.482 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -82.69 59.04 4.53 Favored 'General case' 0 CA--C 1.58 2.119 0 O-C-N 120.63 -1.294 . . . . 0.0 114.39 173.935 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.256 6.0 t 48.38 88.55 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.316 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 175.857 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.3 4.2 mp 73.92 -57.57 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.633 0 C-N-CA 125.419 1.488 . . . . 0.0 111.325 -178.734 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.0 mt -62.29 114.28 3.38 Favored 'General case' 0 N--CA 1.496 1.873 0 CA-C-N 120.833 1.651 . . . . 0.0 109.572 173.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.0 p -85.46 50.04 1.88 Allowed 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 120.257 3.429 . . . . 0.0 120.257 -171.135 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.3 tt -92.37 85.92 5.53 Favored 'General case' 0 N--CA 1.498 1.955 0 N-CA-C 101.799 -3.408 . . . . 0.0 101.799 169.981 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.419 ' HB3' HG11 ' A' ' 57' ' ' VAL . 51.0 m -94.75 109.59 21.53 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 122.464 1.126 . . . . 0.0 112.889 -170.545 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 29.9 ttt85 -123.94 135.5 53.71 Favored 'General case' 0 CA--C 1.562 1.414 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.267 -175.357 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 95.1 m -65.65 145.15 56.39 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 123.779 1.752 . . . . 0.0 114.103 -179.695 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -138.09 -173.08 3.42 Favored 'General case' 0 CA--C 1.566 1.564 0 CA-C-N 113.535 -1.666 . . . . 0.0 112.887 -174.177 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 pp -80.62 151.51 28.99 Favored 'General case' 0 CA--C 1.572 1.791 0 CA-C-O 122.86 1.314 . . . . 0.0 113.506 175.395 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.1 pttt -80.94 143.27 32.74 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 123.616 0.766 . . . . 0.0 110.591 173.66 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.01 152.68 38.7 Favored 'General case' 0 CA--C 1.568 1.669 0 N-CA-C 118.108 2.633 . . . . 0.0 118.108 -171.995 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -102.7 170.23 8.14 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 113.141 -1.845 . . . . 0.0 112.683 -178.533 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -50.18 130.11 22.18 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 115.176 1.547 . . . . 0.0 115.176 -174.727 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 69.32 31.63 3.82 Favored 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -173.35 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 43.4 m -129.8 153.76 47.92 Favored 'General case' 0 CA--C 1.566 1.583 0 CA-C-O 122.763 1.268 . . . . 0.0 111.345 174.98 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -74.72 115.0 13.81 Favored 'General case' 0 CA--C 1.571 1.769 0 CA-C-O 123.462 1.601 . . . . 0.0 113.537 -176.579 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 13.7 p -111.18 152.75 26.69 Favored 'General case' 0 CA--C 1.562 1.439 0 CA-C-N 113.596 -1.638 . . . . 0.0 112.229 174.57 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.9 m -77.46 108.36 10.57 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.363 -1.461 . . . . 0.0 107.546 174.292 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.94 -54.43 7.24 Favored 'General case' 0 CA--C 1.564 1.497 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -172.557 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -93.28 138.32 31.76 Favored 'General case' 0 CA--C 1.565 1.531 0 CA-C-N 118.582 0.628 . . . . 0.0 109.508 173.641 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.8 p -110.34 142.32 42.15 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 123.441 1.591 . . . . 0.0 111.901 178.138 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.72 -144.03 0.3 Allowed 'General case' 0 CA--C 1.568 1.664 0 CA-C-N 113.203 -1.817 . . . . 0.0 108.902 174.115 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -121.21 75.38 1.16 Allowed 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 103.729 -2.693 . . . . 0.0 103.729 171.474 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 174.32 -162.35 32.66 Favored Glycine 0 N--CA 1.485 1.934 0 CA-C-O 122.908 1.282 . . . . 0.0 116.295 -174.549 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.522 HG12 ' HB2' ' A' ' 30' ' ' HIS . 18.6 t -79.29 145.51 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 CA-C-O 122.841 1.305 . . . . 0.0 111.336 -176.032 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -115.35 138.78 50.61 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.016 -173.845 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -66.06 -30.83 71.42 Favored 'General case' 0 CA--C 1.587 2.386 0 O-C-N 120.034 -1.667 . . . . 0.0 115.332 -176.164 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.5 mtmm -153.82 113.49 3.83 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 102.902 -2.999 . . . . 0.0 102.902 172.794 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 67.9 m -39.85 150.23 0.26 Allowed Pre-proline 0 CA--C 1.599 2.837 0 N-CA-C 119.919 3.303 . . . . 0.0 119.919 -173.521 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -69.1 58.46 1.24 Allowed 'Trans proline' 0 CA--C 1.579 2.765 0 N-CA-C 121.674 3.682 . . . . 0.0 121.674 -173.822 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 3.4 t 61.34 162.7 0.07 Allowed 'General case' 0 CA--C 1.582 2.201 0 N-CA-C 117.823 2.527 . . . . 0.0 117.823 174.182 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -75.63 160.37 30.17 Favored 'General case' 0 CA--C 1.574 1.888 0 N-CA-C 115.494 1.665 . . . . 0.0 115.494 178.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -63.23 120.35 11.37 Favored 'General case' 0 CA--C 1.572 1.818 0 CA-C-O 122.553 1.168 . . . . 0.0 113.073 -179.111 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.19 -28.26 15.91 Favored Glycine 0 N--CA 1.498 2.81 0 N-CA-C 116.846 1.498 . . . . 0.0 116.846 -173.219 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.4 mp -98.65 144.9 27.42 Favored 'General case' 0 CA--C 1.565 1.539 0 CA-C-O 122.412 1.101 . . . . 0.0 111.944 -179.128 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.78 153.59 18.64 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 122.083 0.944 . . . . 0.0 112.489 -178.708 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 5.1 t -92.77 96.52 10.2 Favored 'General case' 0 CA--C 1.57 1.719 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.825 174.717 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 . . . . . 0 CA--C 1.57 1.738 0 O-C-N 120.436 -1.415 . . . . 0.0 113.431 -173.966 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 . . . . . 0 CA--C 1.559 1.327 0 N-CA-C 115.528 1.677 . . . . 0.0 115.528 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -108.12 166.75 13.09 Favored Glycine 0 CA--C 1.548 2.154 0 CA-C-N 113.596 -1.638 . . . . 0.0 109.443 170.055 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 38.2 mm -102.37 135.59 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 120.23 -1.747 . . . . 0.0 109.322 179.019 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 28.6 m -62.98 119.52 9.6 Favored 'General case' 0 CA--C 1.572 1.791 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 174.235 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -139.58 153.63 47.43 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 122.452 1.12 . . . . 0.0 109.775 174.902 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -94.22 69.6 3.75 Favored 'General case' 0 N--CA 1.496 1.858 0 CA-C-O 124.02 1.867 . . . . 0.0 115.688 -172.272 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.4 t . . . . . 0 N--CA 1.502 2.14 0 CA-C-N 112.89 -1.959 . . . . 0.0 112.572 174.752 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 . . . . . 0 N--CA 1.505 2.281 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -122.11 151.18 41.2 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 123.866 1.794 . . . . 0.0 115.61 -179.214 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -83.0 166.46 18.79 Favored 'General case' 0 CA--C 1.572 1.819 0 CA-C-N 114.503 -1.226 . . . . 0.0 112.59 173.931 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.44 149.18 33.3 Favored 'General case' 0 CA--C 1.578 2.029 0 O-C-N 120.658 -1.276 . . . . 0.0 109.879 173.677 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.8 30.42 18.06 Favored Glycine 0 CA--C 1.559 2.84 0 O-C-N 121.236 -0.915 . . . . 0.0 114.979 -171.724 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -137.27 141.41 41.97 Favored 'General case' 0 CA--C 1.565 1.542 0 C-N-CA 125.024 1.33 . . . . 0.0 109.528 -174.024 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.7 tt -69.63 117.73 11.6 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.906 -1.121 . . . . 0.0 111.785 -179.054 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 39' ' ' CYS . 22.0 p -124.98 155.68 39.26 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 122.083 0.944 . . . . 0.0 113.222 -175.654 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.1 mp -91.4 -77.48 0.42 Allowed 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 173.841 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -92.38 164.9 13.32 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 115.504 1.668 . . . . 0.0 115.504 174.968 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.3 m -70.6 -22.78 62.51 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 116.474 2.028 . . . . 0.0 116.474 175.434 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.89 6.84 5.52 Favored 'General case' 0 CA--C 1.58 2.111 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 173.095 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -91.82 -41.49 10.62 Favored 'General case' 0 CA--C 1.565 1.527 0 C-N-CA 124.67 1.188 . . . . 0.0 111.899 174.148 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 74.4 m -77.41 136.77 38.43 Favored 'General case' 0 CA--C 1.571 1.787 0 CA-C-N 121.082 1.764 . . . . 0.0 110.476 174.05 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -44.58 -37.43 3.58 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 120.976 3.695 . . . . 0.0 120.976 -172.247 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.2 m -80.69 -83.26 0.11 Allowed 'General case' 0 CA--C 1.57 1.718 0 CA-C-N 118.472 0.578 . . . . 0.0 110.361 173.928 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -175.77 31.08 0.0 OUTLIER 'General case' 0 CA--C 1.588 2.431 0 C-N-CA 124.497 1.119 . . . . 0.0 113.138 -178.255 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 36.7 t -134.9 102.24 5.17 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 118.989 2.959 . . . . 0.0 118.989 -170.506 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 49.5 t -106.03 113.42 26.95 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 102.568 -3.123 . . . . 0.0 102.568 169.018 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.15 123.82 42.39 Favored 'General case' 0 CA--C 1.564 1.484 0 CA-C-O 122.059 0.933 . . . . 0.0 112.297 -173.065 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 20.4 t-80 -77.92 165.45 24.08 Favored 'General case' 0 CA--C 1.567 1.63 0 CA-C-O 122.656 1.217 . . . . 0.0 114.052 -174.742 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -80.35 -101.82 0.03 OUTLIER 'General case' 0 CA--C 1.577 2.006 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 172.631 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.1 p -150.77 90.93 1.67 Allowed 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 120.498 1.499 . . . . 0.0 108.112 174.148 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.271 5.9 mt 70.58 -31.6 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.512 2.67 0 N-CA-C 115.943 1.831 . . . . 0.0 115.943 174.603 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.4 tp -76.62 -123.31 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.151 0 CA-C-N 121.724 2.056 . . . . 0.0 111.03 174.938 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.0 p -162.05 92.82 0.86 Allowed 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 122.433 2.379 . . . . 0.0 114.986 178.11 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.0 tp -150.86 83.83 1.34 Allowed 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 104.067 -2.568 . . . . 0.0 104.067 172.746 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.8 m -104.5 131.34 51.99 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 122.646 1.213 . . . . 0.0 112.795 -173.29 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -131.71 134.82 46.32 Favored 'General case' 0 CA--C 1.562 1.419 0 C-N-CA 124.53 1.132 . . . . 0.0 108.951 -178.659 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 17' ' ' CYS . 99.4 m -65.26 146.92 54.32 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 119.874 -1.766 . . . . 0.0 113.9 178.409 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.42 179.73 6.49 Favored 'General case' 0 CA--C 1.564 1.513 0 CA-C-N 113.979 -1.464 . . . . 0.0 114.025 -173.368 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 98.1 mt -81.26 149.25 29.08 Favored 'General case' 0 CA--C 1.568 1.664 0 CA-C-O 122.097 0.951 . . . . 0.0 112.492 176.118 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -75.99 153.38 36.57 Favored 'General case' 0 CA--C 1.573 1.855 0 CA-C-O 121.856 0.836 . . . . 0.0 111.458 173.943 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.61 157.4 31.95 Favored 'General case' 0 CA--C 1.568 1.655 0 N-CA-C 116.856 2.169 . . . . 0.0 116.856 -173.252 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 43.2 mtp180 -117.58 172.03 7.62 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 113.257 -1.792 . . . . 0.0 111.308 179.45 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -48.59 132.46 17.33 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 116.216 1.932 . . . . 0.0 116.216 -172.972 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 m120 72.75 18.42 4.19 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -173.934 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.4 t -114.45 151.71 32.76 Favored 'General case' 0 CA--C 1.567 1.632 0 CA-C-O 123.11 1.433 . . . . 0.0 112.599 176.096 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -76.74 101.79 5.96 Favored 'General case' 0 CA--C 1.57 1.718 0 C-N-CA 124.86 1.264 . . . . 0.0 113.291 -177.706 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.468 ' SG ' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -99.05 156.52 16.89 Favored 'General case' 0 CA--C 1.564 1.493 0 CA-C-O 123.09 1.424 . . . . 0.0 113.793 177.254 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.1 t -82.46 96.9 8.15 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 171.522 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.6 -47.42 40.54 Favored 'General case' 0 CA--C 1.566 1.583 0 N-CA-C 115.926 1.825 . . . . 0.0 115.926 -173.304 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -89.03 153.12 21.26 Favored 'General case' 0 CA--C 1.57 1.746 0 C-N-CA 123.792 0.837 . . . . 0.0 109.547 172.904 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.1 p -126.27 146.74 49.88 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 123.946 1.831 . . . . 0.0 111.86 176.775 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -105.79 -53.0 2.72 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-N 112.869 -1.969 . . . . 0.0 113.355 175.144 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -164.76 -54.45 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.915 0 C-N-CA 127.14 2.176 . . . . 0.0 107.761 -174.875 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 112.01 94.36 2.19 Favored Glycine 0 N--CA 1.474 1.2 0 N-CA-C 116.916 1.526 . . . . 0.0 116.916 174.513 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.6 t -115.79 140.22 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 119.427 -2.219 . . . . 0.0 107.132 110.157 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -116.9 135.86 53.4 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -172.286 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -64.36 -41.48 96.71 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.616 -1.302 . . . . 0.0 113.377 174.23 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -142.2 110.59 6.05 Favored 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 103.549 -2.759 . . . . 0.0 103.549 172.503 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 57.1 m -53.02 161.5 1.22 Allowed Pre-proline 0 CA--C 1.588 2.427 0 N-CA-C 118.262 2.69 . . . . 0.0 118.262 -174.817 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.468 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 77.8 Cg_exo -53.86 172.34 0.27 Allowed 'Trans proline' 0 CA--C 1.573 2.436 0 C-N-CA 122.954 2.436 . . . . 0.0 117.984 174.917 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 63.0 m -71.5 147.33 47.86 Favored 'General case' 0 CA--C 1.569 1.703 0 O-C-N 120.849 -1.157 . . . . 0.0 113.388 174.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -65.46 153.12 42.27 Favored 'General case' 0 CA--C 1.572 1.825 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 179.006 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 38.7 ttp180 -40.42 -35.65 0.46 Allowed 'General case' 0 N--CA 1.507 2.411 0 N-CA-C 121.574 3.916 . . . . 0.0 121.574 -174.606 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.42 -25.06 74.98 Favored Glycine 0 CA--C 1.555 2.551 0 N-CA-C 119.985 2.754 . . . . 0.0 119.985 173.933 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -135.28 169.22 17.81 Favored 'General case' 0 CA--C 1.574 1.883 0 CA-C-N 120.21 2.005 . . . . 0.0 114.159 179.16 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -98.68 158.17 15.79 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 -173.707 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.7 t -94.86 128.3 41.51 Favored 'General case' 0 CA--C 1.57 1.723 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.046 171.451 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 . . . . . 0 N--CA 1.493 1.722 0 O-C-N 120.006 -1.684 . . . . 0.0 108.152 -178.126 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 116.405 2.002 . . . . 0.0 116.405 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -107.72 151.03 16.96 Favored Glycine 0 CA--C 1.548 2.125 0 CA-C-N 114.458 -1.246 . . . . 0.0 111.19 173.453 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 24.7 mm -92.52 134.91 29.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 120.099 -1.824 . . . . 0.0 110.583 -166.464 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 98.8 m -63.98 123.59 19.39 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 175.013 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -143.73 151.63 40.27 Favored 'General case' 0 CA--C 1.563 1.449 0 CA-C-O 123.612 1.672 . . . . 0.0 110.532 174.875 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -98.08 79.72 2.63 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 124.422 2.058 . . . . 0.0 111.26 -176.071 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.9 t . . . . . 0 CA--C 1.569 1.707 0 CA-C-N 112.012 -2.358 . . . . 0.0 108.056 -175.636 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 69.4 t . . . . . 0 CA--C 1.58 2.132 0 CA-C-O 115.737 -2.078 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.86 98.04 1.04 Allowed 'Trans proline' 0 CA--C 1.569 2.271 0 CA-C-N 125.698 3.071 . . . . 0.0 113.726 178.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . 0.25 3.1 p30 43.33 69.97 2.07 Favored Pre-proline 0 CA--C 1.588 2.423 0 N-CA-C 117.818 2.525 . . . . 0.0 117.818 -178.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -76.57 80.85 2.66 Favored 'Trans proline' 0 CA--C 1.572 2.406 0 C-N-CA 122.711 2.274 . . . . 0.0 113.791 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . 0.259 37.6 ttp180 69.19 -73.82 0.09 Allowed 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 125.919 1.687 . . . . 0.0 112.443 -174.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 64.62 23.84 69.13 Favored Glycine 0 N--CA 1.499 2.856 0 N-CA-C 121.489 3.356 . . . . 0.0 121.489 176.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 13.0 mt -96.13 -14.29 7.91 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.486 0 CA-C-N 118.416 1.108 . . . . 0.0 113.594 -173.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 58.8 mt -71.16 120.83 19.89 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.297 0 O-C-N 119.25 -2.156 . . . . 0.0 110.654 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.291 1.7 pt -100.44 -127.7 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.222 0 C-N-CA 122.875 0.47 . . . . 0.0 111.957 -174.142 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -140.33 81.4 1.81 Allowed 'General case' 0 CA--C 1.579 2.093 0 N-CA-C 116.96 2.207 . . . . 0.0 116.96 -173.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mt -132.42 152.51 51.46 Favored 'General case' 0 N--CA 1.5 2.068 0 CA-C-O 123.695 1.712 . . . . 0.0 113.269 173.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -83.81 163.51 20.1 Favored 'General case' 0 CA--C 1.571 1.752 0 CA-C-N 114.375 -1.284 . . . . 0.0 113.612 177.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.77 137.79 38.64 Favored 'General case' 0 CA--C 1.579 2.062 0 O-C-N 120.867 -1.146 . . . . 0.0 108.011 172.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.33 1.22 44.19 Favored Glycine 0 CA--C 1.56 2.889 0 N-CA-C 115.866 1.106 . . . . 0.0 115.866 -171.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -113.34 149.81 33.48 Favored 'General case' 0 CA--C 1.572 1.807 0 CA-C-N 118.951 1.375 . . . . 0.0 110.283 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.4 tt -69.45 128.12 35.42 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 120.824 -1.172 . . . . 0.0 112.87 -176.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.9 p -128.97 151.78 49.31 Favored 'General case' 0 CA--C 1.562 1.404 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -177.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.9 mt -85.84 -81.5 0.21 Allowed 'General case' 0 CA--C 1.567 1.6 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 173.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -94.53 177.76 5.82 Favored 'General case' 0 N--CA 1.499 1.981 0 CA-C-N 119.311 0.959 . . . . 0.0 112.57 173.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -71.0 -6.19 36.99 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 173.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.31 7.18 4.56 Favored 'General case' 0 CA--C 1.571 1.771 0 N-CA-C 117.128 2.27 . . . . 0.0 117.128 172.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -91.72 -51.2 5.35 Favored 'General case' 0 CA--C 1.567 1.607 0 C-N-CA 124.116 0.966 . . . . 0.0 111.97 -177.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 80.0 m -82.6 147.69 28.44 Favored 'General case' 0 CA--C 1.558 1.267 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -53.56 -53.7 47.98 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 124.039 0.936 . . . . 0.0 111.082 173.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 65.3 m -83.27 104.31 13.33 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 103.568 -2.753 . . . . 0.0 103.568 168.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.87 80.42 0.46 Allowed 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 124.998 2.332 . . . . 0.0 114.624 -172.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.0 t -142.54 72.97 1.39 Allowed 'General case' 0 CA--C 1.56 1.352 0 CA-C-N 112.291 -2.231 . . . . 0.0 110.076 -174.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 34.6 t -78.74 111.38 14.8 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 104.746 -2.316 . . . . 0.0 104.746 172.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -100.42 115.62 30.45 Favored 'General case' 0 CA--C 1.567 1.627 0 CA-C-O 122.997 1.38 . . . . 0.0 114.332 -170.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.605 ' HB2' HG12 ' A' ' 57' ' ' VAL . 15.5 t-80 -82.19 158.22 23.67 Favored 'General case' 0 CA--C 1.566 1.583 0 C-N-CA 126.047 1.739 . . . . 0.0 113.238 -178.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.3 -55.56 32.19 Favored 'General case' 0 CA--C 1.583 2.228 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 174.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.6 t 175.29 -38.88 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.518 0 C-N-CA 125.794 1.638 . . . . 0.0 111.838 -174.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 6.0 tp -157.28 -46.33 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.225 0 CA-C-N 119.95 1.25 . . . . 0.0 113.272 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.6 mt -77.07 -83.44 0.07 Allowed 'General case' 0 N--CA 1.497 1.888 0 CA-C-N 120.708 1.595 . . . . 0.0 112.91 -174.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 96.3 p -154.89 -123.65 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 121.332 1.878 . . . . 0.0 112.934 174.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.1 tt 53.96 80.72 0.11 Allowed 'General case' 0 N--CA 1.503 2.181 0 CA-C-N 120.325 1.42 . . . . 0.0 110.944 -173.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.5 m -117.06 107.65 14.78 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 122.947 1.356 . . . . 0.0 111.262 -174.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 20.7 ttp180 -125.93 141.37 52.01 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.682 1.193 . . . . 0.0 108.616 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 91.1 m -67.08 147.61 52.94 Favored 'General case' 0 CA--C 1.561 1.394 0 O-C-N 119.656 -1.903 . . . . 0.0 114.586 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.14 -177.82 5.18 Favored 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 113.262 -1.79 . . . . 0.0 112.303 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 35.5 tp -85.68 142.95 28.67 Favored 'General case' 0 CA--C 1.571 1.756 0 O-C-N 120.987 -1.071 . . . . 0.0 112.66 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -72.42 143.96 48.33 Favored 'General case' 0 CA--C 1.575 1.937 0 O-C-N 121.497 -0.752 . . . . 0.0 110.186 173.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.26 152.18 36.57 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 118.611 2.819 . . . . 0.0 118.611 -171.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.9 mmt180 -121.48 175.74 6.04 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-N 111.522 -2.581 . . . . 0.0 111.732 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -57.84 127.56 32.67 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -173.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 76.39 29.59 0.7 Allowed 'General case' 0 N--CA 1.504 2.268 0 C-N-CA 125.194 1.398 . . . . 0.0 113.593 -172.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.6 t -124.85 149.6 47.31 Favored 'General case' 0 CA--C 1.566 1.581 0 O-C-N 120.485 -1.385 . . . . 0.0 112.123 175.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -77.85 104.76 8.6 Favored 'General case' 0 CA--C 1.572 1.791 0 CA-C-O 123.533 1.635 . . . . 0.0 113.207 -177.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -101.22 167.58 10.11 Favored 'General case' 0 CA--C 1.575 1.911 0 C-N-CA 125.901 1.68 . . . . 0.0 111.794 173.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.0 t -86.51 -86.7 0.14 Allowed 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 104.984 -2.228 . . . . 0.0 104.984 170.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -156.34 -74.51 0.1 Allowed 'General case' 0 CA--C 1.565 1.557 0 CA-C-N 120.513 1.506 . . . . 0.0 112.606 172.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 23.3 p90 -137.58 177.53 7.8 Favored 'General case' 0 CA--C 1.574 1.875 0 C-N-CA 124.013 0.925 . . . . 0.0 111.548 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.1 p -87.89 135.22 33.49 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.599 -1.313 . . . . 0.0 113.634 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.588 HD12 ' H ' ' A' ' 55' ' ' TYR . 1.0 OUTLIER -100.98 -121.49 0.16 Allowed 'General case' 0 CA--C 1.566 1.563 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 172.533 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.588 ' H ' HD12 ' A' ' 54' ' ' LEU . 60.3 t80 -144.64 74.36 1.41 Allowed 'General case' 0 CA--C 1.57 1.732 0 N-CA-C 103.663 -2.717 . . . . 0.0 103.663 171.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 168.2 -171.57 42.54 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 116.217 1.247 . . . . 0.0 116.217 -174.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.605 HG12 ' HB2' ' A' ' 30' ' ' HIS . 4.4 t -77.65 142.29 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 CA-C-O 122.779 1.276 . . . . 0.0 111.103 -172.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -115.37 126.55 54.55 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.075 -172.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -59.61 -40.99 89.37 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 175.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -142.49 113.24 7.42 Favored 'General case' 0 CA--C 1.56 1.365 0 N-CA-C 102.891 -3.003 . . . . 0.0 102.891 171.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 59.0 m -52.02 144.14 21.61 Favored Pre-proline 0 CA--C 1.586 2.358 0 N-CA-C 115.796 1.776 . . . . 0.0 115.796 -177.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -68.26 179.62 2.81 Favored 'Trans proline' 0 CA--C 1.568 2.187 0 C-N-CA 122.284 1.989 . . . . 0.0 116.411 -174.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 56.7 m -74.06 149.03 41.4 Favored 'General case' 0 CA--C 1.573 1.84 0 O-C-N 121.029 -1.044 . . . . 0.0 112.682 174.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.51 176.51 2.85 Favored 'General case' 0 CA--C 1.583 2.233 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 177.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.4 113.66 4.26 Favored 'General case' 0 CA--C 1.579 2.062 0 O-C-N 119.866 -1.771 . . . . 0.0 112.983 178.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 122.49 -39.11 2.36 Favored Glycine 0 N--CA 1.497 2.737 0 CA-C-N 113.923 -1.49 . . . . 0.0 116.079 -173.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 mp -98.4 151.77 20.2 Favored 'General case' 0 CA--C 1.567 1.604 0 CA-C-O 122.732 1.253 . . . . 0.0 112.704 -177.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -111.23 151.83 27.82 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.158 -0.964 . . . . 0.0 111.407 -179.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 4.0 t -90.65 117.76 29.56 Favored 'General case' 0 CA--C 1.569 1.685 0 C-N-CA 122.827 0.451 . . . . 0.0 111.991 175.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -97.29 93.62 6.62 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.617 -1.302 . . . . 0.0 109.86 -176.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.21 75.32 0.02 OUTLIER Glycine 0 N--CA 1.497 2.707 0 N-CA-C 121.57 3.388 . . . . 0.0 121.57 -173.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -81.06 11.67 3.93 Favored 'General case' 0 CA--C 1.586 2.358 0 N-CA-C 117.055 2.243 . . . . 0.0 117.055 172.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . 0.269 47.5 tptt 73.54 -60.37 0.53 Allowed 'General case' 0 N--CA 1.5 2.062 0 C-N-CA 126.063 1.745 . . . . 0.0 112.421 -173.059 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 32.6 t 44.06 80.6 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 116.095 1.887 . . . . 0.0 116.095 174.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -74.91 53.17 0.58 Allowed 'General case' 0 CA--C 1.578 2.044 0 N-CA-C 117.212 2.301 . . . . 0.0 117.212 -173.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 92.1 t -88.27 77.35 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 CA-C-O 123.508 1.623 . . . . 0.0 106.634 173.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.06 -16.81 0.31 Allowed Glycine 0 CA--C 1.558 2.761 0 N-CA-C 116.867 1.507 . . . . 0.0 116.867 -173.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.1 m 78.3 -60.67 0.4 Allowed 'General case' 0 N--CA 1.503 2.205 0 C-N-CA 126.189 1.796 . . . . 0.0 115.647 176.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.7 tp -139.42 123.98 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 CA-C-O 123.488 1.613 . . . . 0.0 109.013 -178.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.523 HG23 ' H ' ' A' ' 82' ' ' THR . 6.8 t -146.22 175.76 10.26 Favored 'General case' 0 CA--C 1.576 1.943 0 CA-C-N 113.769 -1.56 . . . . 0.0 112.583 179.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -104.78 27.04 8.41 Favored 'General case' 0 CA--C 1.585 2.326 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 172.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.523 ' H ' HG23 ' A' ' 80' ' ' THR . 13.2 t -142.27 -170.21 3.12 Favored 'General case' 0 CA--C 1.577 1.999 0 CA-C-O 125.707 2.67 . . . . 0.0 110.965 -174.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -130.01 125.79 36.17 Favored 'General case' 0 CA--C 1.567 1.631 0 CA-C-N 111.639 -2.528 . . . . 0.0 106.181 173.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.437 ' CE2' HG21 ' A' ' 80' ' ' THR . 59.7 m-85 -99.22 153.23 19.09 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 123.3 1.524 . . . . 0.0 111.402 178.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -153.71 168.25 32.21 Favored Glycine 0 N--CA 1.48 1.59 0 CA-C-N 115.246 -0.888 . . . . 0.0 114.735 -175.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 23.8 mm -97.9 132.43 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.15 -1.206 . . . . 0.0 109.577 -176.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.2 m -67.12 125.83 27.25 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 174.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -143.23 158.95 43.17 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 123.105 1.431 . . . . 0.0 111.832 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -93.81 74.66 4.25 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 123.54 1.638 . . . . 0.0 111.511 -174.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.4 p -134.46 -28.49 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 CA-C-N 113.693 -1.594 . . . . 0.0 115.048 -176.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.16 68.68 1.56 Allowed Glycine 0 N--CA 1.494 2.555 0 N-CA-C 116.185 1.234 . . . . 0.0 116.185 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . 0.308 47.3 ptt85 58.56 -42.02 0.06 Allowed 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 118.795 2.887 . . . . 0.0 118.795 -174.027 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.7 m . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 123.54 1.638 . . . . 0.0 110.553 178.729 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 CA--C 1.582 2.18 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.25 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -80.92 81.75 2.65 Favored 'Trans proline' 0 CA--C 1.57 2.309 0 C-N-CA 122.55 2.167 . . . . 0.0 114.222 -178.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 78.94 92.16 0.05 OUTLIER Pre-proline 0 CA--C 1.581 2.148 0 C-N-CA 126.3 1.84 . . . . 0.0 111.412 -176.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -54.4 -43.08 62.05 Favored 'Trans proline' 0 CA--C 1.57 2.316 0 N-CA-C 118.757 2.561 . . . . 0.0 118.757 176.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -131.58 90.82 2.9 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 174.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -151.3 80.82 0.19 Allowed Glycine 0 N--CA 1.491 2.338 0 O-C-N 121.394 -0.816 . . . . 0.0 114.825 -178.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 65.3 mt -97.22 84.94 1.38 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.055 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 174.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.392 20.4 pt 55.46 -121.16 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 C-N-CA 125.476 1.511 . . . . 0.0 111.764 -174.162 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -124.46 173.34 10.62 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.95 0 CA-C-N 120.237 1.38 . . . . 0.0 111.55 176.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -144.1 94.25 2.55 Favored 'General case' 0 CA--C 1.576 1.973 0 N-CA-C 116.959 2.207 . . . . 0.0 116.959 -172.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.2 tp -159.39 125.15 4.29 Favored 'General case' 0 CA--C 1.579 2.091 0 N-CA-C 105.744 -1.947 . . . . 0.0 105.744 173.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -80.44 165.52 22.12 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 118.874 -2.391 . . . . 0.0 113.486 -175.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.17 144.01 44.99 Favored 'General case' 0 CA--C 1.576 1.974 0 O-C-N 120.962 -1.086 . . . . 0.0 110.037 174.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.79 25.06 26.1 Favored Glycine 0 CA--C 1.563 3.042 0 N-CA-C 114.769 0.668 . . . . 0.0 114.769 -171.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -136.15 148.4 48.18 Favored 'General case' 0 CA--C 1.571 1.762 0 C-N-CA 125.462 1.505 . . . . 0.0 109.132 -178.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 tt -69.1 117.75 11.14 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.59 -1.319 . . . . 0.0 112.284 -176.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 26.5 p -117.42 152.88 34.08 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 121.797 0.808 . . . . 0.0 113.054 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.0 mp -89.87 -78.72 0.36 Allowed 'General case' 0 CA--C 1.568 1.64 0 N-CA-C 106.348 -1.723 . . . . 0.0 106.348 172.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -96.46 168.86 10.29 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 120.59 1.541 . . . . 0.0 114.512 174.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.5 t -70.25 -21.93 62.93 Favored 'General case' 0 N--CA 1.506 2.355 0 N-CA-C 116.332 1.975 . . . . 0.0 116.332 174.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.17 16.74 0.54 Allowed 'General case' 0 CA--C 1.575 1.919 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 174.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 67.7 mt-30 -104.29 -39.66 6.4 Favored 'General case' 0 CA--C 1.572 1.813 0 C-N-CA 125.005 1.322 . . . . 0.0 113.177 173.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.0 m -80.7 149.04 29.9 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 115.54 1.682 . . . . 0.0 115.54 -177.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -57.02 -54.55 45.44 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.114 0.966 . . . . 0.0 110.544 172.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 91.9 p -82.42 101.28 10.54 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 103.766 -2.679 . . . . 0.0 103.766 168.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -69.39 80.47 0.38 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 125.267 2.46 . . . . 0.0 113.89 -172.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.2 t -156.93 82.41 0.94 Allowed 'General case' 0 CA--C 1.56 1.354 0 CA-C-N 112.096 -2.32 . . . . 0.0 110.729 -173.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 29.7 t -81.5 109.08 15.63 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 105.418 -2.068 . . . . 0.0 105.418 172.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.58 123.29 34.11 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-O 122.453 1.12 . . . . 0.0 112.726 -172.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.499 ' HB2' HG12 ' A' ' 57' ' ' VAL . 17.0 t60 -82.02 149.04 28.31 Favored 'General case' 0 CA--C 1.559 1.296 0 CA-C-O 122.707 1.241 . . . . 0.0 113.732 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -65.92 -1.26 2.84 Favored 'General case' 0 CA--C 1.585 2.317 0 N-CA-C 116.279 1.955 . . . . 0.0 116.279 171.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.266 64.9 p 68.84 85.75 0.14 Allowed 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 127.192 2.197 . . . . 0.0 110.384 -178.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.276 5.3 mp 77.41 140.78 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.587 2.379 0 C-N-CA 125.426 1.49 . . . . 0.0 109.364 -173.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.309 10.0 tp 84.94 -138.24 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.103 0 C-N-CA 126.455 1.902 . . . . 0.0 109.19 -174.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 96.4 p -165.3 96.61 0.69 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 121.445 1.929 . . . . 0.0 114.218 178.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 54.6 tp -150.35 89.25 1.56 Allowed 'General case' 0 CA--C 1.564 1.503 0 N-CA-C 103.925 -2.62 . . . . 0.0 103.925 173.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.8 m -104.51 132.85 50.28 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 122.832 1.301 . . . . 0.0 113.394 -172.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -136.93 133.56 35.82 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.528 1.131 . . . . 0.0 108.822 -177.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 55.2 m -66.57 146.46 54.48 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 124.341 2.019 . . . . 0.0 113.703 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -138.25 -178.08 5.12 Favored 'General case' 0 CA--C 1.564 1.483 0 CA-C-N 112.615 -2.084 . . . . 0.0 112.338 -174.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.5 tp -83.83 125.09 31.62 Favored 'General case' 0 CA--C 1.569 1.706 0 O-C-N 121.313 -0.867 . . . . 0.0 111.05 174.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -61.02 148.5 39.98 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 123.891 0.876 . . . . 0.0 112.508 174.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.21 152.53 42.17 Favored 'General case' 0 CA--C 1.564 1.517 0 N-CA-C 118.529 2.788 . . . . 0.0 118.529 -170.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.63 168.09 9.31 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 112.82 -1.991 . . . . 0.0 111.45 -174.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -51.59 139.42 20.57 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -178.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.354 10.9 p30 57.75 28.9 16.57 Favored 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -172.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.9 m -129.43 153.1 48.27 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-O 122.691 1.234 . . . . 0.0 110.55 174.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -69.5 137.27 52.4 Favored 'General case' 0 CA--C 1.578 2.044 0 CA-C-O 124.631 2.158 . . . . 0.0 115.354 -175.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 27.3 p -142.0 147.59 37.16 Favored 'General case' 0 CA--C 1.566 1.592 0 CA-C-N 112.241 -2.254 . . . . 0.0 110.691 -178.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 60.2 m -77.62 104.48 8.18 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 119.707 -1.871 . . . . 0.0 108.025 174.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.465 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . . . -78.85 43.93 0.52 Allowed 'General case' 0 CA--C 1.573 1.855 0 N-CA-C 118.732 2.864 . . . . 0.0 118.732 -173.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.9 p90 -164.29 138.01 5.3 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 126.096 1.758 . . . . 0.0 107.834 -174.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.5 p -114.21 137.68 51.46 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-O 122.883 1.325 . . . . 0.0 109.96 174.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.275 2.1 pp -96.22 -78.74 0.46 Allowed 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 113.821 -1.536 . . . . 0.0 108.48 176.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -159.84 -14.67 0.06 Allowed 'General case' 0 CA--C 1.587 2.378 0 C-N-CA 125.584 1.554 . . . . 0.0 112.757 176.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -164.59 -93.05 0.09 OUTLIER Glycine 0 N--CA 1.478 1.496 0 O-C-N 120.127 -1.608 . . . . 0.0 115.87 -174.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.499 HG12 ' HB2' ' A' ' 30' ' ' HIS . 1.9 t -79.28 143.94 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.191 0 CA-C-N 119.18 1.49 . . . . 0.0 112.243 -164.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -126.86 144.05 51.09 Favored 'General case' 0 CA--C 1.56 1.346 0 N-CA-C 114.96 1.466 . . . . 0.0 114.96 -172.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -69.65 -44.65 70.14 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.832 173.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -139.13 115.86 10.74 Favored 'General case' 0 CA--C 1.565 1.553 0 N-CA-C 102.783 -3.043 . . . . 0.0 102.783 173.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 58.2 m -53.5 145.71 27.16 Favored Pre-proline 0 CA--C 1.591 2.548 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 -174.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -79.0 65.57 8.85 Favored 'Trans proline' 0 CA--C 1.571 2.372 0 C-N-CA 123.498 2.799 . . . . 0.0 117.42 -173.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 58.1 m 58.97 165.17 0.05 OUTLIER 'General case' 0 CA--C 1.579 2.086 0 N-CA-C 117.048 2.24 . . . . 0.0 117.048 176.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -72.61 149.71 43.7 Favored 'General case' 0 CA--C 1.567 1.627 0 O-C-N 120.818 -1.176 . . . . 0.0 112.978 174.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.73 103.98 0.98 Allowed 'General case' 0 N--CA 1.499 2.003 0 CA-C-O 122.83 1.3 . . . . 0.0 112.368 -174.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 131.09 -32.01 3.07 Favored Glycine 0 CA--C 1.558 2.774 0 CA-C-N 114.344 -1.298 . . . . 0.0 114.58 -171.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mp -96.77 151.5 19.58 Favored 'General case' 0 CA--C 1.566 1.59 0 CA-C-O 122.77 1.271 . . . . 0.0 111.456 172.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -99.36 154.53 18.12 Favored 'General case' 0 CA--C 1.562 1.404 0 CA-C-O 122.291 1.043 . . . . 0.0 112.142 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.465 ' SG ' ' HB2' ' A' ' 51' ' ' ALA . 17.2 t -93.71 118.43 31.4 Favored 'General case' 0 CA--C 1.569 1.68 0 CA-C-N 115.327 -0.851 . . . . 0.0 108.79 172.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -96.88 99.01 10.58 Favored 'General case' 0 CA--C 1.57 1.732 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -172.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.07 124.87 3.11 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 117.491 1.756 . . . . 0.0 117.491 173.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -55.61 -45.55 77.47 Favored 'General case' 0 N--CA 1.504 2.233 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 172.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp 55.74 -103.25 0.17 Allowed 'General case' 0 N--CA 1.5 2.061 0 C-N-CA 125.597 1.559 . . . . 0.0 113.454 174.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.9 m 68.93 105.15 0.06 Allowed 'General case' 0 CA--C 1.567 1.633 0 C-N-CA 126.237 1.815 . . . . 0.0 113.407 174.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.9 mt -69.69 100.29 1.46 Allowed 'General case' 0 N--CA 1.49 1.552 0 CA-C-O 122.474 1.13 . . . . 0.0 110.813 176.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.2 p -71.56 69.38 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.586 2.363 0 CA-C-O 124.762 2.22 . . . . 0.0 112.83 175.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 157.72 54.09 0.01 OUTLIER Glycine 0 CA--C 1.552 2.394 0 CA-C-N 113.531 -1.668 . . . . 0.0 111.749 -174.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.5 m -171.64 140.66 1.37 Allowed 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 125.245 1.418 . . . . 0.0 108.215 -171.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 18.5 pt -78.96 -47.81 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 N-CA-C 117.384 2.364 . . . . 0.0 117.384 -173.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 80.3 p -133.63 -69.61 0.54 Allowed 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 117.108 2.262 . . . . 0.0 117.108 -172.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -84.61 87.89 7.3 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 103.297 -2.853 . . . . 0.0 103.297 172.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . 0.281 18.6 p -95.04 -92.58 0.2 Allowed 'General case' 0 CA--C 1.56 1.348 0 CA-C-N 114.435 -1.257 . . . . 0.0 109.349 -170.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -161.6 85.48 0.64 Allowed 'General case' 0 N--CA 1.495 1.792 0 CA-C-N 120.722 1.601 . . . . 0.0 108.649 173.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 99.5 m-85 -95.71 161.98 13.8 Favored 'General case' 0 CA--C 1.573 1.861 0 O-C-N 120.749 -1.22 . . . . 0.0 111.816 -174.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -55.96 154.11 14.81 Favored Glycine 0 N--CA 1.499 2.87 0 N-CA-C 117.712 1.845 . . . . 0.0 117.712 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 42.6 mm -99.8 137.13 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 O-C-N 120.668 -1.489 . . . . 0.0 110.804 -172.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 67.3 m -68.72 124.25 23.14 Favored 'General case' 0 CA--C 1.572 1.814 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 174.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 69.9 m-70 -141.47 163.11 33.82 Favored 'General case' 0 CA--C 1.565 1.539 0 O-C-N 120.628 -1.295 . . . . 0.0 111.048 178.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -95.82 85.45 4.11 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 123.483 1.611 . . . . 0.0 111.981 -175.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 48.0 t -126.42 77.65 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 CA-C-N 113.535 -1.666 . . . . 0.0 106.862 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -84.83 -60.02 1.92 Allowed Glycine 0 N--CA 1.495 2.627 0 N-CA-C 117.613 1.805 . . . . 0.0 117.613 -175.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 53.0 ttp180 -137.04 -67.77 0.49 Allowed 'General case' 0 N--CA 1.497 1.882 0 CA-C-N 117.864 0.832 . . . . 0.0 111.862 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.7 t . . . . . 0 N--CA 1.501 2.085 0 N-CA-C 115.667 1.729 . . . . 0.0 115.667 -178.598 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 88.4 t . . . . . 0 CA--C 1.578 2.051 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -84.62 59.54 5.72 Favored 'Trans proline' 0 CA--C 1.572 2.424 0 CA-C-N 122.733 2.012 . . . . 0.0 114.963 -178.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -162.52 126.34 1.9 Allowed Pre-proline 0 CA--C 1.578 2.029 0 O-C-N 120.928 -1.107 . . . . 0.0 110.192 -176.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -80.32 76.31 4.6 Favored 'Trans proline' 0 CA--C 1.572 2.422 0 CA-C-N 123.177 2.17 . . . . 0.0 114.424 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -135.0 91.61 2.77 Favored 'General case' 0 CA--C 1.565 1.53 0 CA-C-O 121.88 0.848 . . . . 0.0 109.77 -177.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.8 -51.86 37.75 Favored Glycine 0 N--CA 1.498 2.8 0 N-CA-C 118.017 1.967 . . . . 0.0 118.017 175.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . 0.307 6.6 tp 42.1 34.16 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.549 0 N-CA-C 120.005 3.335 . . . . 0.0 120.005 170.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 18.0 tt -95.33 116.39 36.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 119.955 -1.716 . . . . 0.0 111.418 -174.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.253 15.1 pt -105.36 -105.12 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.666 -0.646 . . . . 0.0 109.394 176.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.304 1.0 OUTLIER 54.18 53.16 11.42 Favored 'General case' 0 N--CA 1.507 2.39 0 N-CA-C 118.918 2.933 . . . . 0.0 118.918 174.949 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.1 mp -99.01 123.07 43.05 Favored 'General case' 0 CA--C 1.567 1.625 0 CA-C-O 122.778 1.275 . . . . 0.0 112.052 175.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -84.78 169.92 13.73 Favored 'General case' 0 CA--C 1.574 1.892 0 O-C-N 121.129 -0.982 . . . . 0.0 111.087 172.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.77 123.58 17.44 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.621 -1.3 . . . . 0.0 111.471 175.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 111.12 -6.2 28.83 Favored Glycine 0 CA--C 1.559 2.804 0 N-CA-C 117.157 1.623 . . . . 0.0 117.157 -172.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -99.09 135.73 40.08 Favored 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 119.635 1.718 . . . . 0.0 111.857 -178.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.6 tt -76.04 128.04 34.2 Favored 'General case' 0 CA--C 1.575 1.924 0 O-C-N 121.46 -0.775 . . . . 0.0 112.183 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.6 p -120.7 -171.78 2.25 Favored 'General case' 0 CA--C 1.577 1.998 0 CA-C-O 123.206 1.479 . . . . 0.0 114.702 -174.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.6 mt -112.29 -75.92 0.6 Allowed 'General case' 0 CA--C 1.578 2.025 0 N-CA-C 103.815 -2.661 . . . . 0.0 103.815 169.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.1 p30 -93.91 -177.67 4.41 Favored 'General case' 0 CA--C 1.589 2.47 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 172.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.0 m -84.95 -17.66 36.99 Favored 'General case' 0 N--CA 1.508 2.428 0 N-CA-C 116.289 1.959 . . . . 0.0 116.289 173.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.25 7.4 2.82 Favored 'General case' 0 CA--C 1.583 2.241 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 173.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -94.4 -40.78 9.75 Favored 'General case' 0 CA--C 1.568 1.66 0 C-N-CA 126.17 1.788 . . . . 0.0 110.862 173.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.7 m -76.24 117.18 17.66 Favored 'General case' 0 CA--C 1.566 1.586 0 CA-C-N 119.449 1.022 . . . . 0.0 109.604 173.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -77.63 9.56 3.3 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 118.007 2.595 . . . . 0.0 118.007 -174.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 65.0 p -81.15 -88.32 0.08 Allowed 'General case' 0 CA--C 1.581 2.152 0 N-CA-C 104.346 -2.464 . . . . 0.0 104.346 169.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -171.41 25.71 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.167 0 C-N-CA 125.996 1.718 . . . . 0.0 111.056 171.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 5.9 t -161.51 120.57 2.46 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 119.003 2.964 . . . . 0.0 119.003 -170.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 35.4 t -103.4 119.99 39.94 Favored 'General case' 0 CA--C 1.56 1.352 0 N-CA-C 102.651 -3.092 . . . . 0.0 102.651 167.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -93.31 115.37 27.95 Favored 'General case' 0 CA--C 1.562 1.425 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 -172.191 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.639 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.9 t-160 -84.04 114.6 21.85 Favored 'General case' 0 CA--C 1.567 1.596 0 C-N-CA 124.55 1.14 . . . . 0.0 112.228 -178.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -82.78 89.75 6.82 Favored 'General case' 0 CA--C 1.571 1.768 0 O-C-N 119.927 -1.733 . . . . 0.0 111.439 174.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.305 5.6 t 52.6 -177.0 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -176.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 28.5 mm -57.65 -28.78 32.91 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.607 0 O-C-N 118.937 -2.352 . . . . 0.0 114.812 -179.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.6 mt -51.98 -21.91 3.5 Favored 'General case' 0 N--CA 1.503 2.177 0 N-CA-C 118.544 2.794 . . . . 0.0 118.544 174.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.406 39.2 p 100.19 -122.65 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 127.67 2.388 . . . . 0.0 112.187 174.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 31.0 tp 45.48 76.84 0.09 Allowed 'General case' 0 N--CA 1.504 2.233 0 CA-C-N 120.426 1.466 . . . . 0.0 112.978 -173.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 48.6 m -98.14 108.23 20.89 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-O 122.023 0.916 . . . . 0.0 112.51 -172.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 34.2 ttm105 -118.17 136.55 53.56 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 124.091 0.956 . . . . 0.0 110.331 -176.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 62.6 m -62.92 154.21 31.01 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 117.59 2.441 . . . . 0.0 117.59 -174.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.95 -175.8 4.36 Favored 'General case' 0 CA--C 1.572 1.791 0 CA-C-N 112.713 -2.04 . . . . 0.0 112.443 -177.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.8 tp -116.88 171.88 7.61 Favored 'General case' 0 CA--C 1.572 1.821 0 O-C-N 121.204 -0.935 . . . . 0.0 110.929 176.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -56.32 145.35 27.27 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.814 -1.179 . . . . 0.0 113.706 174.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.1 149.62 35.7 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-O 123.928 1.823 . . . . 0.0 115.267 -174.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 44.4 mtp180 -107.68 169.19 8.74 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-N 112.715 -2.039 . . . . 0.0 111.731 -178.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -51.18 125.52 14.19 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -174.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 77.84 7.76 2.6 Favored 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -173.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.0 t -102.46 157.25 17.05 Favored 'General case' 0 CA--C 1.564 1.498 0 CA-C-O 123.104 1.431 . . . . 0.0 112.472 174.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -76.96 107.11 9.07 Favored 'General case' 0 CA--C 1.567 1.629 0 CA-C-O 123.218 1.485 . . . . 0.0 114.477 -173.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 23.1 p -114.96 147.61 39.81 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 113.373 -1.739 . . . . 0.0 113.237 176.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.0 t -104.8 130.82 52.83 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 170.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.85 -39.11 66.79 Favored 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 176.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -95.01 160.13 14.71 Favored 'General case' 0 CA--C 1.574 1.871 0 C-N-CA 125.541 1.536 . . . . 0.0 110.18 172.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 35.7 p -128.98 152.32 48.72 Favored 'General case' 0 N--CA 1.497 1.876 0 CA-C-O 123.592 1.663 . . . . 0.0 110.434 173.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -97.38 -59.35 1.8 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 114.133 -1.394 . . . . 0.0 112.187 175.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -164.68 -52.31 0.03 OUTLIER 'General case' 0 CA--C 1.572 1.804 0 C-N-CA 126.195 1.798 . . . . 0.0 109.476 -176.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 100.69 102.4 2.52 Favored Glycine 0 CA--C 1.542 1.756 0 CA-C-O 122.754 1.197 . . . . 0.0 114.749 -177.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.639 HG12 ' HB2' ' A' ' 30' ' ' HIS . 13.8 t -103.58 141.33 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.123 0 O-C-N 118.09 -3.006 . . . . 0.0 107.704 83.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -113.4 133.91 54.92 Favored 'General case' 0 CA--C 1.553 1.058 0 N-CA-C 116.691 2.108 . . . . 0.0 116.691 -171.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -85.3 6.1 27.71 Favored 'General case' 0 CA--C 1.595 2.694 0 CA-C-N 115.04 -0.982 . . . . 0.0 113.482 169.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.85 102.95 0.79 Allowed 'General case' 0 CA--C 1.57 1.745 0 C-N-CA 127.563 2.345 . . . . 0.0 107.104 -171.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 95.6 m -67.56 131.95 92.92 Favored Pre-proline 0 CA--C 1.581 2.161 0 O-C-N 118.827 -2.42 . . . . 0.0 113.216 175.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -48.95 152.1 4.99 Favored 'Trans proline' 0 CA--C 1.569 2.227 0 C-N-CA 122.949 2.433 . . . . 0.0 116.68 175.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 1.8 t -74.25 150.68 40.14 Favored 'General case' 0 CA--C 1.572 1.826 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -173.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -67.76 162.38 24.0 Favored 'General case' 0 CA--C 1.574 1.886 0 N-CA-C 115.872 1.804 . . . . 0.0 115.872 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -64.25 119.05 9.54 Favored 'General case' 0 CA--C 1.572 1.808 0 O-C-N 120.735 -1.228 . . . . 0.0 111.754 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.91 -32.2 6.72 Favored Glycine 0 N--CA 1.494 2.56 0 CA-C-N 114.687 -1.142 . . . . 0.0 115.738 -172.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.6 mp -99.4 143.19 29.94 Favored 'General case' 0 CA--C 1.563 1.473 0 CA-C-O 122.798 1.285 . . . . 0.0 111.251 176.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.7 150.13 21.53 Favored 'General case' 0 CA--C 1.561 1.37 0 CA-C-O 122.449 1.118 . . . . 0.0 111.428 179.033 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 7.7 t -97.06 114.84 26.52 Favored 'General case' 0 CA--C 1.567 1.606 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.579 173.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -95.93 98.88 10.74 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.476 -1.39 . . . . 0.0 109.835 177.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -74.76 57.19 2.6 Favored Glycine 0 N--CA 1.498 2.815 0 N-CA-C 120.42 2.928 . . . . 0.0 120.42 -174.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.78 81.97 1.65 Allowed 'General case' 0 CA--C 1.572 1.817 0 C-N-CA 123.849 0.859 . . . . 0.0 111.043 175.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 71.7 tttt 64.69 -31.49 0.13 Allowed 'General case' 0 N--CA 1.509 2.488 0 N-CA-C 119.619 3.192 . . . . 0.0 119.619 175.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 27.6 p 70.91 43.72 0.66 Allowed 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 126.367 1.867 . . . . 0.0 115.783 -174.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 54.72 78.22 0.18 Allowed 'General case' 0 N--CA 1.503 2.222 0 C-N-CA 124.74 1.216 . . . . 0.0 112.733 -177.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . 0.339 0.9 OUTLIER 53.39 -1.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.504 0 N-CA-C 120.182 3.401 . . . . 0.0 120.182 -174.949 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.49 80.16 0.85 Allowed Glycine 0 N--CA 1.488 2.146 0 CA-C-N 120.572 1.533 . . . . 0.0 115.874 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.9 t -64.99 -9.92 25.44 Favored 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 119.176 3.028 . . . . 0.0 119.176 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.4 mp -121.69 -67.74 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.576 1.969 0 N-CA-C 104.75 -2.315 . . . . 0.0 104.75 173.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 36.7 p -129.77 168.21 16.89 Favored 'General case' 0 CA--C 1.573 1.846 0 C-N-CA 124.765 1.226 . . . . 0.0 108.734 171.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -132.82 94.92 3.47 Favored 'General case' 0 CA--C 1.563 1.473 0 O-C-N 120.142 -1.599 . . . . 0.0 111.915 -173.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 72.8 p -122.42 -94.22 0.5 Allowed 'General case' 0 N--CA 1.501 2.111 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 173.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -143.29 80.79 1.69 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.462 -1.399 . . . . 0.0 108.367 173.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -101.9 -178.6 3.76 Favored 'General case' 0 CA--C 1.572 1.812 0 CA-C-O 121.772 0.796 . . . . 0.0 111.866 -176.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -141.84 -174.79 14.8 Favored Glycine 0 N--CA 1.493 2.466 0 O-C-N 119.778 -1.826 . . . . 0.0 116.822 176.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.6 mm -126.49 142.95 41.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 CA-C-O 122.101 0.953 . . . . 0.0 110.081 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 8.0 m -73.83 127.77 33.73 Favored 'General case' 0 CA--C 1.569 1.71 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 173.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 72.3 m-70 -140.52 155.86 46.5 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.824 -1.172 . . . . 0.0 109.623 174.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -92.41 81.14 4.89 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 119.528 -1.982 . . . . 0.0 113.064 -173.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 72.5 t -115.34 -41.6 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 CA-C-N 112.685 -2.052 . . . . 0.0 112.865 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -66.01 -40.24 95.14 Favored Glycine 0 N--CA 1.497 2.714 0 N-CA-C 120.116 2.806 . . . . 0.0 120.116 -178.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 30.5 ttm105 70.41 -57.96 0.56 Allowed 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.494 1.728 0 CA-C-O 124.181 1.943 . . . . 0.0 115.102 -176.412 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 CA--C 1.579 2.069 0 CA-C-O 118.644 -0.693 . . . . 0.0 110.259 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -79.79 88.61 1.41 Allowed 'Trans proline' 0 CA--C 1.571 2.353 0 C-N-CA 122.434 2.089 . . . . 0.0 113.917 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -105.67 113.28 64.2 Favored Pre-proline 0 CA--C 1.576 1.962 0 CA-C-O 118.04 -0.981 . . . . 0.0 112.106 -175.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -68.19 19.97 0.13 Allowed 'Trans proline' 0 CA--C 1.582 2.898 0 N-CA-C 120.171 3.104 . . . . 0.0 120.171 174.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 27.1 ttt180 -141.5 117.27 10.4 Favored 'General case' 0 CA--C 1.564 1.5 0 C-N-CA 124.919 1.287 . . . . 0.0 107.778 178.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.07 -107.58 0.47 Allowed Glycine 0 N--CA 1.488 2.123 0 O-C-N 121.668 -0.645 . . . . 0.0 113.8 174.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 45.9 mm -93.54 -53.84 7.98 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 C-N-CA 122.738 0.415 . . . . 0.0 112.01 -175.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.2 pt -82.38 72.23 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 CA-C-N 119.811 1.187 . . . . 0.0 113.406 -174.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.25 32.3 pt -118.86 -139.2 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.577 1.991 0 C-N-CA 123.709 0.804 . . . . 0.0 108.968 175.259 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 58.46 62.39 1.98 Allowed 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 116.135 1.902 . . . . 0.0 116.135 176.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 36.7 tp -115.15 123.5 49.09 Favored 'General case' 0 CA--C 1.576 1.964 0 O-C-N 120.578 -1.327 . . . . 0.0 111.649 -177.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -66.1 162.81 18.83 Favored 'General case' 0 CA--C 1.576 1.976 0 O-C-N 119.757 -1.84 . . . . 0.0 115.624 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.31 130.38 44.24 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-O 121.928 0.87 . . . . 0.0 111.123 174.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 116.74 -13.8 14.8 Favored Glycine 0 CA--C 1.557 2.711 0 N-CA-C 116.844 1.498 . . . . 0.0 116.844 -172.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -103.98 151.15 23.54 Favored 'General case' 0 CA--C 1.567 1.627 0 CA-C-N 119.123 1.461 . . . . 0.0 112.716 -176.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.0 tt -73.33 123.43 23.76 Favored 'General case' 0 CA--C 1.574 1.888 0 O-C-N 121.308 -0.87 . . . . 0.0 112.095 -178.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.4 p -123.57 155.13 38.22 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 -176.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 mp -89.22 -76.67 0.4 Allowed 'General case' 0 CA--C 1.568 1.666 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 174.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -95.68 170.06 9.59 Favored 'General case' 0 CA--C 1.576 1.965 0 N-CA-C 114.414 1.264 . . . . 0.0 114.414 173.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 66.8 m -76.87 -21.58 54.74 Favored 'General case' 0 N--CA 1.507 2.381 0 N-CA-C 117.244 2.313 . . . . 0.0 117.244 176.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.79 7.26 3.23 Favored 'General case' 0 CA--C 1.583 2.229 0 N-CA-C 116.813 2.153 . . . . 0.0 116.813 174.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -96.2 -24.88 16.04 Favored 'General case' 0 CA--C 1.57 1.716 0 N-CA-C 115.662 1.727 . . . . 0.0 115.662 176.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 18.6 m -78.27 171.69 14.69 Favored 'General case' 0 CA--C 1.58 2.131 0 CA-C-N 121.029 1.74 . . . . 0.0 114.161 177.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -68.41 -65.37 0.71 Allowed 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.516 -1.365 . . . . 0.0 108.234 172.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 57.7 m -83.28 109.36 17.19 Favored 'General case' 0 CA--C 1.565 1.537 0 N-CA-C 101.157 -3.645 . . . . 0.0 101.157 168.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -67.66 82.36 0.18 Allowed 'General case' 0 N--CA 1.503 2.201 0 CA-C-O 125.158 2.409 . . . . 0.0 114.833 -171.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.8 t -145.25 77.39 1.52 Allowed 'General case' 0 CA--C 1.562 1.415 0 CA-C-N 111.549 -2.569 . . . . 0.0 112.482 -172.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.9 t -79.38 117.41 20.34 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 103.862 -2.644 . . . . 0.0 103.862 171.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.39 111.18 23.49 Favored 'General case' 0 CA--C 1.566 1.588 0 CA-C-O 123.256 1.503 . . . . 0.0 114.726 -169.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.517 ' HB2' HG12 ' A' ' 57' ' ' VAL . 0.1 OUTLIER -85.56 172.1 11.21 Favored 'General case' 0 CA--C 1.572 1.803 0 C-N-CA 126.514 1.926 . . . . 0.0 111.82 174.744 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -76.1 -62.91 1.44 Allowed 'General case' 0 CA--C 1.588 2.407 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 169.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.6 p -147.26 -92.45 0.09 Allowed 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 102.329 -3.211 . . . . 0.0 102.329 172.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 92.3 mt -119.07 -12.13 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.592 2.567 0 CA-C-N 121.661 2.028 . . . . 0.0 113.318 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.9 tp -127.3 94.71 4.07 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 122.652 2.478 . . . . 0.0 112.214 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.7 p -172.43 164.7 5.71 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 124.473 1.109 . . . . 0.0 112.949 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 15.6 tp -75.56 121.45 22.42 Favored 'General case' 0 CA--C 1.574 1.892 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 171.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.4 m -95.69 138.89 32.71 Favored 'General case' 0 CA--C 1.569 1.693 0 O-C-N 121.246 -0.909 . . . . 0.0 113.304 -172.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 18.5 ttp180 -132.64 144.07 50.09 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.377 -0.827 . . . . 0.0 111.831 -175.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 71.6 m -63.76 138.4 58.47 Favored 'General case' 0 CA--C 1.566 1.574 0 O-C-N 119.676 -1.89 . . . . 0.0 113.302 175.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -138.88 -172.14 3.25 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-N 113.937 -1.483 . . . . 0.0 113.243 -173.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.5 mt -89.2 151.14 22.33 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-O 122.261 1.029 . . . . 0.0 112.74 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.15 152.66 36.64 Favored 'General case' 0 CA--C 1.572 1.825 0 O-C-N 121.619 -0.676 . . . . 0.0 112.525 173.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.476 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . . . -79.93 171.14 15.51 Favored 'General case' 0 CA--C 1.573 1.833 0 CA-C-O 123.435 1.588 . . . . 0.0 114.186 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -118.83 164.97 14.62 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-O 122.897 1.332 . . . . 0.0 112.304 -174.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -61.24 137.77 58.23 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.299 -0.875 . . . . 0.0 113.209 178.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 64.58 26.37 13.27 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -173.096 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 52.4 m -123.01 149.62 44.09 Favored 'General case' 0 CA--C 1.561 1.378 0 CA-C-O 122.929 1.347 . . . . 0.0 110.186 174.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -75.63 102.13 5.22 Favored 'General case' 0 CA--C 1.576 1.945 0 CA-C-O 124.213 1.959 . . . . 0.0 114.131 -176.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.446 ' SG ' ' HA ' ' A' ' 62' ' ' PRO . 4.4 t -95.29 149.61 21.16 Favored 'General case' 0 CA--C 1.565 1.543 0 CA-C-O 124.066 1.889 . . . . 0.0 111.122 173.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 24.7 p -93.33 113.01 25.09 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 114.405 -1.27 . . . . 0.0 108.307 174.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.4 -8.32 59.02 Favored 'General case' 0 CA--C 1.563 1.462 0 N-CA-C 117.426 2.38 . . . . 0.0 117.426 -175.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . 0.334 0.2 OUTLIER -94.65 176.12 6.4 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 117.383 2.364 . . . . 0.0 117.383 -174.513 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.4 m 79.04 -147.08 0.02 OUTLIER 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 100.793 -3.78 . . . . 0.0 100.793 -167.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 54' ' ' LEU 0.596 2.8 mm? -177.98 -77.0 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.025 0 O-C-N 116.991 -3.568 . . . . 0.0 110.583 162.243 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -77.87 -20.31 53.25 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.91 -1.119 . . . . 0.0 112.607 171.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -90.0 -152.42 26.87 Favored Glycine 0 CA--C 1.55 2.242 0 CA-C-O 123.338 1.521 . . . . 0.0 112.507 172.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.517 HG12 ' HB2' ' A' ' 30' ' ' HIS . 10.0 t -84.62 139.41 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 CA-C-O 123.026 1.394 . . . . 0.0 114.038 -165.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -105.65 156.16 18.54 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -174.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -90.91 -68.07 0.81 Allowed 'General case' 0 N--CA 1.503 2.215 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 -175.042 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -116.91 96.03 5.28 Favored 'General case' 0 CA--C 1.567 1.616 0 N-CA-C 101.747 -3.427 . . . . 0.0 101.747 170.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 66.9 m -39.03 149.86 0.23 Allowed Pre-proline 0 CA--C 1.578 2.03 0 N-CA-C 120.547 3.536 . . . . 0.0 120.547 -173.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.446 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 78.8 Cg_endo -65.63 170.9 10.41 Favored 'Trans proline' 0 CA--C 1.568 2.197 0 C-N-CA 122.223 1.949 . . . . 0.0 114.552 174.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.476 ' SG ' ' HB3' ' A' ' 43' ' ' ALA . 95.3 m -88.76 178.37 6.48 Favored 'General case' 0 CA--C 1.571 1.758 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 -174.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -61.55 174.53 0.75 Allowed 'General case' 0 CA--C 1.579 2.092 0 N-CA-C 117.494 2.405 . . . . 0.0 117.494 -174.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 24.6 tpt180 -61.02 111.63 1.76 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.124 -1.61 . . . . 0.0 113.136 -175.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 96.79 -19.74 53.49 Favored Glycine 0 N--CA 1.499 2.88 0 N-CA-C 116.892 1.517 . . . . 0.0 116.892 -172.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.94 120.35 38.17 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 124.804 1.242 . . . . 0.0 108.603 176.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.81 164.31 12.62 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 115.532 1.679 . . . . 0.0 115.532 -172.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 14.4 t -91.8 104.41 16.86 Favored 'General case' 0 CA--C 1.566 1.559 0 CA-C-N 113.306 -1.77 . . . . 0.0 107.32 171.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -91.78 99.2 12.12 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-N 121.525 1.966 . . . . 0.0 107.533 -177.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -72.32 64.87 1.34 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 117.283 1.673 . . . . 0.0 117.283 -175.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -53.33 -48.95 68.05 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 124.903 1.281 . . . . 0.0 114.423 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 46.6 tttt -111.93 0.73 16.18 Favored 'General case' 0 CA--C 1.587 2.395 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 172.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.0 m -85.03 60.86 6.51 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 119.728 -1.857 . . . . 0.0 112.47 174.096 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.3 tt -160.1 -58.37 0.06 Allowed 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 124.6 1.16 . . . . 0.0 109.323 -174.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 10.7 p -76.59 77.19 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.578 2.044 0 CA-C-O 123.377 1.56 . . . . 0.0 112.121 175.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -155.81 -59.61 0.01 OUTLIER Glycine 0 N--CA 1.493 2.439 0 N-CA-C 116.641 1.416 . . . . 0.0 116.641 -176.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 63.2 m 59.64 24.57 13.41 Favored 'General case' 0 N--CA 1.509 2.475 0 N-CA-C 118.548 2.795 . . . . 0.0 118.548 178.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.493 HG23 ' H ' ' A' ' 80' ' ' THR 0.309 9.7 tp -145.46 -103.16 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 120.28 -1.513 . . . . 0.0 107.404 175.468 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.493 ' H ' HG23 ' A' ' 79' ' ' ILE . 9.6 p -101.41 128.11 47.75 Favored 'General case' 0 N--CA 1.498 1.965 0 CA-C-N 120.887 1.676 . . . . 0.0 109.631 174.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -87.45 79.52 8.37 Favored 'General case' 0 CA--C 1.568 1.661 0 CA-C-O 122.768 1.271 . . . . 0.0 113.344 -174.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 24.6 p -96.52 -19.36 19.16 Favored 'General case' 0 N--CA 1.51 2.539 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 173.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -77.1 106.01 8.54 Favored 'General case' 0 CA--C 1.57 1.716 0 C-N-CA 124.608 1.163 . . . . 0.0 108.35 173.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -98.66 168.63 10.03 Favored 'General case' 0 CA--C 1.574 1.876 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -172.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -126.92 171.7 18.53 Favored Glycine 0 N--CA 1.494 2.507 0 O-C-N 120.915 -1.116 . . . . 0.0 114.397 175.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.6 mm -96.96 139.99 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.246 0 O-C-N 119.883 -1.951 . . . . 0.0 112.118 -168.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 3.8 m -74.3 131.92 41.61 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.249 -1.532 . . . . 0.0 114.39 173.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 64.7 m-70 -140.59 158.62 43.72 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 122.531 1.158 . . . . 0.0 110.98 177.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -95.94 130.21 42.98 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 120.964 -1.085 . . . . 0.0 111.623 -176.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.6 p -143.83 -50.02 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.886 0 N-CA-C 114.719 1.377 . . . . 0.0 114.719 -173.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -102.21 63.51 0.48 Allowed Glycine 0 N--CA 1.496 2.678 0 O-C-N 120.796 -1.19 . . . . 0.0 115.895 178.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 22.4 tpp85 -101.04 106.38 17.66 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-N 117.616 0.708 . . . . 0.0 112.004 -174.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.5 t . . . . . 0 N--CA 1.501 2.102 0 N-CA-C 116.604 2.075 . . . . 0.0 116.604 175.453 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 28.3 m . . . . . 0 CA--C 1.584 2.263 0 CA-C-O 114.524 -2.655 . . . . 0.0 116.903 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -81.36 77.52 3.94 Favored 'Trans proline' 0 CA--C 1.571 2.37 0 CA-C-N 127.713 3.79 . . . . 0.0 115.108 -174.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.6 t70 53.62 66.91 4.06 Favored Pre-proline 0 CA--C 1.591 2.555 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -78.03 159.4 30.53 Favored 'Trans proline' 0 CA--C 1.57 2.301 0 C-N-CA 122.531 2.154 . . . . 0.0 114.597 174.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.4 tpt180 -82.19 69.65 8.96 Favored 'General case' 0 N--CA 1.5 2.042 0 CA-C-O 123.542 1.639 . . . . 0.0 112.88 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.35 44.22 0.16 Allowed Glycine 0 N--CA 1.492 2.402 0 CA-C-N 114.419 -1.264 . . . . 0.0 115.256 177.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 10.3 tp -87.4 75.02 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.57 1.743 0 CA-C-O 122.818 1.294 . . . . 0.0 110.709 -175.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.255 24.0 mm 78.42 -52.17 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.612 0 C-N-CA 125.073 1.349 . . . . 0.0 111.364 -174.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 29.9 pt -98.79 175.96 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.579 2.095 0 CA-C-N 119.307 0.958 . . . . 0.0 111.432 175.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 84.73 82.51 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 126.65 1.98 . . . . 0.0 111.028 -174.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.73 139.9 51.99 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 123.363 1.554 . . . . 0.0 114.61 -176.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.5 156.88 30.71 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 122.241 1.02 . . . . 0.0 113.138 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -80.9 119.7 23.78 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 122.716 1.246 . . . . 0.0 109.02 -175.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 129.64 -20.61 5.16 Favored Glycine 0 CA--C 1.558 2.769 0 CA-C-N 114.222 -1.354 . . . . 0.0 114.692 -171.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.284 6.0 tp10 -99.62 158.85 15.47 Favored 'General case' 0 CA--C 1.572 1.802 0 CA-C-N 119.436 1.618 . . . . 0.0 112.036 -178.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.8 tp -75.37 135.44 40.81 Favored 'General case' 0 CA--C 1.578 2.028 0 O-C-N 120.963 -1.085 . . . . 0.0 113.714 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.9 p -133.85 159.74 39.75 Favored 'General case' 0 CA--C 1.564 1.514 0 C-N-CA 124.871 1.268 . . . . 0.0 112.361 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.7 mt -92.48 -77.14 0.44 Allowed 'General case' 0 CA--C 1.566 1.59 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 173.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.3 p30 -91.24 167.38 12.36 Favored 'General case' 0 CA--C 1.58 2.117 0 N-CA-C 115.43 1.641 . . . . 0.0 115.43 174.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.2 m -70.51 -20.79 62.81 Favored 'General case' 0 N--CA 1.509 2.52 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 174.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.96 4.45 5.37 Favored 'General case' 0 CA--C 1.579 2.088 0 N-CA-C 116.909 2.188 . . . . 0.0 116.909 174.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -94.83 -31.48 13.7 Favored 'General case' 0 CA--C 1.565 1.522 0 C-N-CA 125.082 1.353 . . . . 0.0 114.371 174.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 11.2 m -78.17 157.59 29.34 Favored 'General case' 0 CA--C 1.574 1.881 0 CA-C-N 121.703 2.047 . . . . 0.0 114.18 177.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -61.97 -57.07 13.1 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.753 -1.217 . . . . 0.0 109.506 172.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.7 m -83.82 110.6 18.48 Favored 'General case' 0 CA--C 1.567 1.597 0 N-CA-C 102.737 -3.06 . . . . 0.0 102.737 169.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -66.27 82.47 0.09 Allowed 'General case' 0 N--CA 1.502 2.141 0 CA-C-O 124.187 1.946 . . . . 0.0 114.153 -172.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.6 t -154.03 82.75 1.14 Allowed 'General case' 0 CA--C 1.567 1.611 0 CA-C-N 112.843 -1.98 . . . . 0.0 112.956 -173.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.9 t -85.6 111.86 20.44 Favored 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 104.231 -2.507 . . . . 0.0 104.231 171.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.15 123.06 43.16 Favored 'General case' 0 CA--C 1.561 1.388 0 CA-C-O 122.443 1.116 . . . . 0.0 112.841 -171.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -79.82 129.5 34.53 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.111 0.964 . . . . 0.0 112.404 -173.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -76.41 43.57 0.31 Allowed 'General case' 0 CA--C 1.583 2.218 0 N-CA-C 116.414 2.005 . . . . 0.0 116.414 174.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 43.7 p 61.03 88.28 0.09 Allowed 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 125.769 1.628 . . . . 0.0 114.306 174.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 23.6 mm 75.11 -57.19 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.613 0 C-N-CA 125.138 1.375 . . . . 0.0 113.264 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -42.67 -44.98 4.52 Favored 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 118.361 2.726 . . . . 0.0 118.361 -177.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.338 28.6 p 96.47 -4.91 0.07 Allowed 'General case' 0 N--CA 1.507 2.408 0 N-CA-C 118.81 2.893 . . . . 0.0 118.81 173.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 mp -74.61 95.35 2.8 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 121.926 2.148 . . . . 0.0 106.609 172.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.8 m -97.64 134.07 41.33 Favored 'General case' 0 CA--C 1.559 1.317 0 CA-C-N 114.661 -1.154 . . . . 0.0 113.67 -170.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 68.3 ttp85 -114.24 144.57 43.0 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.224 1.01 . . . . 0.0 111.687 -176.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 75.1 m -69.4 132.5 46.46 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 119.92 -1.737 . . . . 0.0 111.096 173.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.27 178.92 7.08 Favored 'General case' 0 CA--C 1.568 1.643 0 N-CA-C 115.151 1.537 . . . . 0.0 115.151 -173.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.571 HD13 ' H ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -86.82 160.29 18.81 Favored 'General case' 0 CA--C 1.573 1.842 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 178.054 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.59 156.63 25.08 Favored 'General case' 0 CA--C 1.582 2.173 0 CA-C-O 121.923 0.868 . . . . 0.0 112.533 175.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.01 166.21 21.79 Favored 'General case' 0 CA--C 1.572 1.819 0 N-CA-C 116.588 2.07 . . . . 0.0 116.588 -175.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 13.4 mtp-105 -131.33 171.39 13.41 Favored 'General case' 0 CA--C 1.564 1.519 0 CA-C-N 113.961 -1.472 . . . . 0.0 111.555 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -45.98 129.79 9.71 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 116.682 2.105 . . . . 0.0 116.682 -174.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 73.04 10.1 5.31 Favored 'General case' 0 N--CA 1.505 2.298 0 N-CA-C 115.623 1.712 . . . . 0.0 115.623 -174.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.0 t -107.92 159.49 16.49 Favored 'General case' 0 CA--C 1.567 1.607 0 CA-C-O 122.969 1.366 . . . . 0.0 111.286 174.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -71.39 128.4 35.73 Favored 'General case' 0 CA--C 1.563 1.466 0 CA-C-O 123.164 1.459 . . . . 0.0 114.006 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -122.37 128.53 51.09 Favored 'General case' 0 CA--C 1.561 1.387 0 CA-C-N 113.304 -1.771 . . . . 0.0 108.974 173.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.3 t -86.7 97.49 10.61 Favored 'General case' 0 CA--C 1.558 1.253 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.555 173.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.413 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . . . -78.52 76.63 5.02 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 123.616 1.674 . . . . 0.0 112.159 -176.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -144.67 153.74 42.06 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 117.419 2.378 . . . . 0.0 117.419 -171.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.1 p -149.25 135.96 19.54 Favored 'General case' 0 CA--C 1.558 1.267 0 CA-C-O 124.265 1.983 . . . . 0.0 106.3 169.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.287 1.9 pp -141.35 -80.11 0.25 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 112.982 -1.917 . . . . 0.0 105.917 -176.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -150.84 -1.42 0.37 Allowed 'General case' 0 CA--C 1.591 2.522 0 C-N-CA 126.409 1.883 . . . . 0.0 110.759 172.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 170.97 -83.71 0.08 OUTLIER Glycine 0 C--N 1.351 1.391 0 O-C-N 119.046 -2.284 . . . . 0.0 117.686 -173.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 2.4 t -78.39 137.05 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 CA-C-N 119.758 1.779 . . . . 0.0 113.035 -157.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -123.96 130.5 52.69 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.109 -1.405 . . . . 0.0 110.458 -173.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -62.54 -43.73 98.09 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -178.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.6 mptt -139.33 106.87 5.57 Favored 'General case' 0 CA--C 1.562 1.434 0 N-CA-C 103.519 -2.771 . . . . 0.0 103.519 173.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.0 m -49.65 147.78 5.82 Favored Pre-proline 0 CA--C 1.591 2.525 0 N-CA-C 117.058 2.244 . . . . 0.0 117.058 -174.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -60.75 172.35 2.92 Favored 'Trans proline' 0 CA--C 1.569 2.231 0 C-N-CA 122.877 2.385 . . . . 0.0 118.003 -173.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 35.3 m -73.0 161.69 30.39 Favored 'General case' 0 CA--C 1.573 1.833 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -174.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -62.53 156.73 22.2 Favored 'General case' 0 CA--C 1.577 2.007 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -61.73 109.45 1.22 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.745 -1.222 . . . . 0.0 113.495 -174.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.86 -24.82 18.35 Favored Glycine 0 N--CA 1.5 2.923 0 N-CA-C 116.502 1.361 . . . . 0.0 116.502 -172.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 tt -98.28 136.7 38.09 Favored 'General case' 0 CA--C 1.574 1.877 0 C-N-CA 124.897 1.279 . . . . 0.0 109.034 176.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.89 159.01 15.2 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 116.855 2.169 . . . . 0.0 116.855 -172.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.413 ' SG ' ' HB2' ' A' ' 51' ' ' ALA . 9.1 t -95.55 132.43 40.68 Favored 'General case' 0 CA--C 1.573 1.849 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.329 171.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . 0.298 2.8 pp20? -95.0 -158.91 0.68 Allowed 'General case' 0 N--CA 1.506 2.339 0 CA-C-N 122.096 2.226 . . . . 0.0 112.169 177.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -132.57 83.54 0.3 Allowed Glycine 0 N--CA 1.492 2.416 0 O-C-N 119.372 -2.08 . . . . 0.0 117.612 -173.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 47.0 m-20 -87.16 96.61 10.37 Favored 'General case' 0 CA--C 1.567 1.634 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 168.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -71.35 132.28 44.62 Favored 'General case' 0 CA--C 1.571 1.786 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 -174.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.1 t -72.07 -51.51 21.29 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 174.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.6 tt 69.93 -66.22 0.28 Allowed 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 125.947 1.699 . . . . 0.0 114.883 173.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.2 p -79.03 -47.59 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 N-CA-C 115.528 1.677 . . . . 0.0 115.528 -176.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.5 95.43 1.2 Allowed Glycine 0 N--CA 1.488 2.102 0 N-CA-C 116.329 1.292 . . . . 0.0 116.329 178.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 97.6 p -77.69 84.1 4.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.539 -0.977 . . . . 0.0 109.119 165.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.428 0.2 OUTLIER 64.19 -50.91 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.537 0 C-N-CA 126.406 1.882 . . . . 0.0 113.471 -171.632 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.255 54.4 m -121.43 172.96 7.68 Favored 'General case' 0 CA--C 1.582 2.208 0 C-N-CA 126.276 1.831 . . . . 0.0 109.333 173.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -78.98 74.73 5.5 Favored 'General case' 0 CA--C 1.579 2.06 0 O-C-N 119.631 -1.918 . . . . 0.0 110.527 174.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 56.4 p -110.03 72.94 0.81 Allowed 'General case' 0 N--CA 1.502 2.142 0 CA-C-O 125.005 2.336 . . . . 0.0 114.527 -173.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -161.88 115.92 1.89 Allowed 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 111.058 -2.792 . . . . 0.0 104.148 172.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -130.97 163.92 26.48 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-O 122.097 0.951 . . . . 0.0 112.822 -173.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.42 162.17 41.12 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 118.608 2.203 . . . . 0.0 118.608 175.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 19.6 mm -98.43 148.3 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.003 0 CA-C-O 122.587 1.184 . . . . 0.0 109.459 176.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.8 m -72.66 125.3 27.15 Favored 'General case' 0 CA--C 1.571 1.765 0 O-C-N 120.397 -1.439 . . . . 0.0 113.153 173.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 70.7 m-70 -140.51 152.29 45.46 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 120.245 -1.534 . . . . 0.0 111.573 176.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -96.94 122.57 40.06 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-O 122.102 0.953 . . . . 0.0 109.674 177.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 46.0 t -82.92 -34.77 11.72 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -174.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -166.29 -82.92 0.05 OUTLIER Glycine 0 N--CA 1.488 2.116 0 O-C-N 121.079 -1.013 . . . . 0.0 113.518 175.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 31.5 tpt180 -135.78 -73.9 0.45 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 117.138 0.469 . . . . 0.0 111.066 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.8 m . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 124.44 2.067 . . . . 0.0 113.44 -175.137 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 31.1 m . . . . . 0 CA--C 1.584 2.262 0 CA-C-O 114.374 -2.726 . . . . 0.0 116.504 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -70.5 77.79 1.31 Allowed 'Trans proline' 0 CA--C 1.575 2.543 0 CA-C-N 127.37 3.668 . . . . 0.0 117.302 -177.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . 0.267 18.1 t70 -92.63 -64.63 0.14 Allowed Pre-proline 0 CA--C 1.581 2.152 0 CA-C-O 115.922 -1.989 . . . . 0.0 111.17 176.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -76.51 97.7 1.15 Allowed 'Trans proline' 0 CA--C 1.571 2.337 0 CA-C-N 125.382 2.958 . . . . 0.0 111.21 173.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.7 mmm180 -85.26 69.29 10.72 Favored 'General case' 0 CA--C 1.572 1.798 0 N-CA-C 115.185 1.55 . . . . 0.0 115.185 -173.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -171.95 -101.19 0.14 Allowed Glycine 0 N--CA 1.483 1.806 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 174.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . 0.266 11.0 tp -137.86 -64.27 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.578 2.04 0 C-N-CA 124.254 1.022 . . . . 0.0 110.066 175.085 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.258 18.0 tt -134.46 -67.43 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 N-CA-C 102.728 -3.064 . . . . 0.0 102.728 172.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.259 29.5 pt -108.76 -146.8 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.586 2.359 0 N-CA-C 106.116 -1.809 . . . . 0.0 106.116 170.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 57.97 80.08 0.18 Allowed 'General case' 0 CA--C 1.582 2.204 0 N-CA-C 116.374 1.99 . . . . 0.0 116.374 176.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -149.68 146.05 27.04 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 123.34 1.543 . . . . 0.0 113.249 173.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -84.82 171.64 12.09 Favored 'General case' 0 CA--C 1.569 1.709 0 N-CA-C 114.071 1.138 . . . . 0.0 114.071 -178.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.21 127.51 31.62 Favored 'General case' 0 CA--C 1.575 1.906 0 O-C-N 121.14 -0.975 . . . . 0.0 111.466 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 117.41 -20.74 11.06 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 117.061 1.584 . . . . 0.0 117.061 -173.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -101.87 153.44 19.84 Favored 'General case' 0 CA--C 1.575 1.912 0 CA-C-N 119.064 1.432 . . . . 0.0 112.319 -179.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 tt -74.55 129.66 38.16 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.075 -1.016 . . . . 0.0 113.464 -174.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 15.6 p -127.02 151.24 48.86 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 124.272 1.029 . . . . 0.0 112.955 178.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.8 mp -87.79 -71.78 0.56 Allowed 'General case' 0 CA--C 1.57 1.719 0 O-C-N 120.946 -1.096 . . . . 0.0 108.46 173.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -95.25 173.48 7.53 Favored 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 120.531 1.514 . . . . 0.0 114.563 173.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.3 m -77.98 -19.1 55.11 Favored 'General case' 0 N--CA 1.505 2.282 0 N-CA-C 117.204 2.298 . . . . 0.0 117.204 176.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.91 10.69 2.64 Favored 'General case' 0 CA--C 1.58 2.131 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 172.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -94.41 -46.66 6.92 Favored 'General case' 0 CA--C 1.558 1.287 0 CA-C-O 117.67 -1.157 . . . . 0.0 113.071 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.9 m -65.87 149.24 50.51 Favored 'General case' 0 CA--C 1.576 1.959 0 CA-C-N 122.076 2.216 . . . . 0.0 113.685 178.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.0 mmmp? -59.37 -53.61 56.17 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 120.621 -1.3 . . . . 0.0 110.536 172.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 87.6 p -82.96 100.0 10.15 Favored 'General case' 0 CA--C 1.572 1.817 0 N-CA-C 102.179 -3.267 . . . . 0.0 102.179 167.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 51.6 m-80 -67.64 85.46 0.19 Allowed 'General case' 0 N--CA 1.501 2.12 0 CA-C-O 125.238 2.447 . . . . 0.0 114.611 -170.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 t -152.31 77.77 1.2 Allowed 'General case' 0 CA--C 1.562 1.424 0 CA-C-N 111.216 -2.72 . . . . 0.0 110.725 -173.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.3 t -82.1 111.16 17.98 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 172.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.52 130.28 46.57 Favored 'General case' 0 CA--C 1.556 1.193 0 CA-C-O 122.145 0.974 . . . . 0.0 111.338 -172.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -79.42 173.34 12.68 Favored 'General case' 0 CA--C 1.568 1.638 0 N-CA-C 114.894 1.442 . . . . 0.0 114.894 -173.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 44.6 p-10 -80.46 -63.98 1.29 Allowed 'General case' 0 CA--C 1.568 1.673 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 173.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.5 m -160.8 -83.76 0.04 OUTLIER 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 104.479 -2.415 . . . . 0.0 104.479 171.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 69.4 mt -123.53 -22.45 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.302 0 CA-C-N 120.116 1.325 . . . . 0.0 112.805 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.9 tp -76.89 -113.94 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 122.467 2.394 . . . . 0.0 111.642 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 95.3 p -161.05 101.67 1.26 Allowed 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 122.733 2.515 . . . . 0.0 115.571 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.8 tp -163.79 86.36 0.49 Allowed 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 103.821 -2.659 . . . . 0.0 103.821 172.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 11.8 m -105.77 129.56 53.94 Favored 'General case' 0 CA--C 1.566 1.576 0 CA-C-O 122.532 1.158 . . . . 0.0 112.712 -172.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 19.2 ttp180 -132.49 146.59 52.05 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.368 1.067 . . . . 0.0 110.655 -175.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 73.2 m -67.98 142.32 56.0 Favored 'General case' 0 CA--C 1.563 1.475 0 O-C-N 119.821 -1.799 . . . . 0.0 113.598 176.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.83 -173.81 3.81 Favored 'General case' 0 CA--C 1.569 1.693 0 CA-C-N 114.202 -1.363 . . . . 0.0 113.664 -174.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.9 mt -92.29 154.37 18.64 Favored 'General case' 0 CA--C 1.57 1.736 0 CA-C-O 122.47 1.128 . . . . 0.0 112.732 176.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.85 150.63 34.16 Favored 'General case' 0 CA--C 1.575 1.909 0 C-N-CA 123.648 0.779 . . . . 0.0 112.387 173.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.67 158.63 29.62 Favored 'General case' 0 CA--C 1.568 1.653 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 -173.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -115.23 168.59 9.82 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 113.464 -1.698 . . . . 0.0 111.414 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -53.55 130.16 35.02 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -174.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 72.05 27.91 2.6 Favored 'General case' 0 N--CA 1.506 2.338 0 C-N-CA 124.875 1.27 . . . . 0.0 114.101 -173.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.8 m -125.08 150.03 47.23 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.658 -1.277 . . . . 0.0 110.345 174.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -71.68 131.19 42.81 Favored 'General case' 0 CA--C 1.57 1.74 0 CA-C-O 122.941 1.353 . . . . 0.0 112.452 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.416 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 25.0 p -134.14 160.74 36.89 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-N 113.74 -1.573 . . . . 0.0 114.995 -174.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.1 m -79.38 101.94 8.41 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.892 0.854 . . . . 0.0 109.672 176.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -76.86 -47.56 20.93 Favored 'General case' 0 CA--C 1.571 1.783 0 N-CA-C 115.751 1.76 . . . . 0.0 115.751 -174.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 11.3 p90 -102.7 104.84 15.2 Favored 'General case' 0 CA--C 1.568 1.635 0 C-N-CA 124.599 1.16 . . . . 0.0 108.057 174.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.3 p -98.55 134.29 41.72 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 123.559 1.647 . . . . 0.0 113.799 -174.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -98.58 -170.83 2.01 Favored 'General case' 0 CA--C 1.578 2.031 0 CA-C-N 112.462 -2.153 . . . . 0.0 108.939 172.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -99.58 62.23 1.2 Allowed 'General case' 0 N--CA 1.501 2.119 0 CA-C-O 123.518 1.628 . . . . 0.0 108.38 174.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -169.49 -168.79 31.95 Favored Glycine 0 N--CA 1.475 1.275 0 CA-C-O 123.593 1.663 . . . . 0.0 114.149 -173.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.1 t -78.78 147.68 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 CA-C-O 123.215 1.483 . . . . 0.0 112.619 -163.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -117.09 138.34 51.69 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-N 114.313 -1.312 . . . . 0.0 113.396 -173.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -68.36 -33.16 73.77 Favored 'General case' 0 CA--C 1.589 2.479 0 O-C-N 121.256 -0.902 . . . . 0.0 112.697 172.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.56 109.65 3.72 Favored 'General case' 0 CA--C 1.566 1.59 0 N-CA-C 105.324 -2.102 . . . . 0.0 105.324 177.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 59.2 m -52.17 157.05 2.42 Favored Pre-proline 0 CA--C 1.591 2.551 0 N-CA-C 118.78 2.881 . . . . 0.0 118.78 -174.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -54.14 167.18 1.29 Allowed 'Trans proline' 0 CA--C 1.566 2.094 0 C-N-CA 123.374 2.716 . . . . 0.0 118.032 176.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.416 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 69.3 m -71.43 162.2 29.83 Favored 'General case' 0 CA--C 1.574 1.884 0 N-CA-C 115.028 1.492 . . . . 0.0 115.028 177.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -62.62 161.18 12.61 Favored 'General case' 0 CA--C 1.576 1.966 0 N-CA-C 115.624 1.712 . . . . 0.0 115.624 177.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 72.3 ttt180 -62.0 116.88 5.28 Favored 'General case' 0 CA--C 1.572 1.792 0 O-C-N 120.697 -1.252 . . . . 0.0 112.888 -175.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.29 -21.44 41.33 Favored Glycine 0 CA--C 1.559 2.842 0 N-CA-C 117.101 1.6 . . . . 0.0 117.101 -172.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 tp -99.78 141.27 32.8 Favored 'General case' 0 CA--C 1.572 1.814 0 C-N-CA 124.803 1.241 . . . . 0.0 111.545 -179.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -99.11 151.27 21.16 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.409 -1.432 . . . . 0.0 113.945 -174.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 13.1 t -95.41 99.12 11.08 Favored 'General case' 0 CA--C 1.57 1.715 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.49 172.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -97.17 116.6 29.67 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.483 -1.386 . . . . 0.0 110.38 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -140.37 153.58 23.58 Favored Glycine 0 N--CA 1.475 1.263 0 CA-C-O 124.756 2.309 . . . . 0.0 114.317 -174.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -122.0 -61.68 1.47 Allowed 'General case' 0 CA--C 1.567 1.613 0 CA-C-N 112.079 -2.061 . . . . 0.0 111.487 176.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -147.72 161.45 41.18 Favored 'General case' 0 CA--C 1.573 1.852 0 CA-C-N 120.045 1.293 . . . . 0.0 111.093 -174.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 85.4 p -85.97 -44.66 12.17 Favored 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 173.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -133.44 -73.94 0.49 Allowed 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 119.657 1.117 . . . . 0.0 110.571 -178.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.538 HG13 ' H ' ' A' ' 77' ' ' GLY 0.3 14.9 p -109.56 -91.5 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 CA-C-N 119.358 0.981 . . . . 0.0 111.656 -176.341 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.538 ' H ' HG13 ' A' ' 76' ' ' VAL . . . -152.61 77.98 0.21 Allowed Glycine 0 N--CA 1.491 2.308 0 O-C-N 121.062 -1.024 . . . . 0.0 114.149 -177.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.1 m -158.96 139.26 12.27 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 124.082 0.953 . . . . 0.0 109.721 175.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 11.8 pt -74.74 -93.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.728 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 26.8 p 62.45 -171.75 0.16 Allowed 'General case' 0 N--CA 1.509 2.497 0 CA-C-N 122.259 2.3 . . . . 0.0 113.538 174.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -64.7 -16.69 63.25 Favored 'General case' 0 CA--C 1.59 2.502 0 O-C-N 120.207 -1.558 . . . . 0.0 114.897 171.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 6.7 t -114.06 84.14 1.99 Allowed 'General case' 0 CA--C 1.567 1.599 0 CA-C-O 125.316 2.484 . . . . 0.0 111.355 177.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -134.3 93.24 3.04 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 111.74 -2.482 . . . . 0.0 105.536 174.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.0 m-30 -99.39 164.53 12.07 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 116.216 1.932 . . . . 0.0 116.216 -170.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -146.17 174.55 26.04 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 115.902 1.121 . . . . 0.0 115.902 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.8 mm -111.39 143.27 21.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 CA-C-O 122.17 0.986 . . . . 0.0 109.865 -177.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.413 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 69.4 m -71.04 120.61 16.85 Favored 'General case' 0 CA--C 1.569 1.701 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 174.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 71.8 m-70 -142.02 161.07 38.91 Favored 'General case' 0 CA--C 1.565 1.55 0 CA-C-O 123.349 1.547 . . . . 0.0 111.751 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -97.66 102.36 14.1 Favored 'General case' 0 CA--C 1.563 1.466 0 O-C-N 120.932 -1.105 . . . . 0.0 110.732 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 41.4 t -125.25 73.48 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 CA-C-O 122.354 1.074 . . . . 0.0 108.635 -175.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -88.79 29.79 5.7 Favored Glycine 0 N--CA 1.5 2.944 0 N-CA-C 119.494 2.558 . . . . 0.0 119.494 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -159.94 -69.4 0.07 Allowed 'General case' 0 N--CA 1.496 1.834 0 CA-C-N 118.974 1.387 . . . . 0.0 109.316 175.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 32.9 t . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 124.74 2.209 . . . . 0.0 110.625 -177.601 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 13.9 p . . . . . 0 CA--C 1.581 2.137 0 CA-C-O 118.976 -0.535 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -68.94 86.86 0.46 Allowed 'Trans proline' 0 CA--C 1.572 2.397 0 C-N-CA 122.698 2.266 . . . . 0.0 115.635 177.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -104.11 106.68 54.43 Favored Pre-proline 0 CA--C 1.578 2.033 0 CA-C-O 118.079 -0.962 . . . . 0.0 111.541 -176.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -79.09 84.38 2.06 Favored 'Trans proline' 0 CA--C 1.571 2.344 0 C-N-CA 122.388 2.059 . . . . 0.0 112.967 175.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.4 ppt_? -68.47 -9.63 50.04 Favored 'General case' 0 CA--C 1.577 2.007 0 N-CA-C 119.613 3.19 . . . . 0.0 119.613 -174.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.64 78.01 0.08 OUTLIER Glycine 0 N--CA 1.488 2.11 0 CA-C-N 120.525 1.511 . . . . 0.0 114.077 178.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . 0.289 46.2 mm 63.29 -71.09 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 C-N-CA 126.477 1.911 . . . . 0.0 113.868 176.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.5 mt 71.39 127.02 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 C-N-CA 125.424 1.489 . . . . 0.0 110.601 -178.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.8 pt -97.49 164.01 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 120.407 -1.433 . . . . 0.0 112.047 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 86.88 75.97 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.123 0 C-N-CA 126.795 2.038 . . . . 0.0 110.499 -174.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.439 ' H ' ' HA ' ' A' ' 23' ' ' CYS . 0.7 OUTLIER -125.83 149.85 48.31 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 123.402 1.572 . . . . 0.0 113.799 -177.847 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -79.5 165.05 23.42 Favored 'General case' 0 CA--C 1.573 1.832 0 O-C-N 120.944 -1.097 . . . . 0.0 112.358 174.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.21 132.64 44.37 Favored 'General case' 0 CA--C 1.574 1.868 0 O-C-N 120.611 -1.306 . . . . 0.0 111.348 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 116.28 13.89 8.0 Favored Glycine 0 CA--C 1.558 2.776 0 N-CA-C 115.705 1.042 . . . . 0.0 115.705 -172.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -129.49 152.3 49.17 Favored 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 119.187 1.493 . . . . 0.0 110.433 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 54.3 mt -72.28 125.94 28.58 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.095 -1.003 . . . . 0.0 113.304 -177.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.8 p -121.29 143.51 49.13 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 124.164 0.985 . . . . 0.0 112.271 -177.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.5 mt -78.77 -72.13 0.4 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.035 -1.04 . . . . 0.0 109.279 174.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 60.7 m-20 -99.03 -165.59 1.25 Allowed 'General case' 0 CA--C 1.578 2.046 0 CA-C-N 119.229 0.922 . . . . 0.0 112.551 172.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.1 t -82.8 -24.68 33.29 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 119.784 -1.822 . . . . 0.0 114.964 172.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.24 62.66 6.06 Favored 'General case' 0 CA--C 1.574 1.867 0 CA-C-O 125.057 2.36 . . . . 0.0 111.672 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -137.68 -59.49 0.67 Allowed 'General case' 0 CA--C 1.566 1.558 0 CA-C-N 111.531 -2.577 . . . . 0.0 109.929 -174.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.439 ' HA ' ' H ' ' A' ' 11' ' ' LEU . 71.9 m -83.29 155.03 23.82 Favored 'General case' 0 CA--C 1.57 1.734 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 175.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.6 mtpt -60.75 -53.51 56.51 Favored 'General case' 0 N--CA 1.502 2.147 0 C-N-CA 124.089 0.956 . . . . 0.0 109.877 171.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 92.2 p -81.88 101.84 10.48 Favored 'General case' 0 CA--C 1.569 1.689 0 N-CA-C 105.353 -2.091 . . . . 0.0 105.353 170.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -72.7 76.72 1.11 Allowed 'General case' 0 N--CA 1.501 2.121 0 CA-C-O 124.973 2.32 . . . . 0.0 113.418 -173.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.8 t -139.94 70.54 1.36 Allowed 'General case' 0 CA--C 1.562 1.427 0 CA-C-N 111.99 -2.368 . . . . 0.0 108.28 -178.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.2 t -78.0 108.75 11.5 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 173.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.18 120.16 39.46 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-O 122.861 1.315 . . . . 0.0 112.856 -171.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.46 ' HB2' HG12 ' A' ' 57' ' ' VAL . 1.9 t60 -82.18 153.6 25.89 Favored 'General case' 0 CA--C 1.563 1.48 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -174.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -76.8 8.2 3.94 Favored 'General case' 0 CA--C 1.586 2.352 0 N-CA-C 116.402 2.001 . . . . 0.0 116.402 172.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.277 44.3 p 75.81 97.07 0.07 Allowed 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 127.063 2.145 . . . . 0.0 111.681 -178.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.28 4.2 mp 75.27 -46.94 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 C-N-CA 125.565 1.546 . . . . 0.0 114.305 174.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.0 mp -77.83 -126.85 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.158 0 CA-C-N 121.565 1.984 . . . . 0.0 112.249 -174.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.1 p -156.84 94.6 1.45 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 122.924 2.602 . . . . 0.0 116.119 178.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 tt -161.28 92.75 0.92 Allowed 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 103.724 -2.695 . . . . 0.0 103.724 173.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.5 m -110.32 116.11 30.88 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.312 -0.868 . . . . 0.0 112.222 -173.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -124.12 137.55 54.54 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 124.242 1.017 . . . . 0.0 109.782 -178.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 98.5 m -68.58 142.39 55.19 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 119.989 -1.694 . . . . 0.0 113.46 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -135.35 -176.75 4.37 Favored 'General case' 0 CA--C 1.565 1.555 0 CA-C-N 113.558 -1.656 . . . . 0.0 113.183 -173.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.6 pp -82.29 161.9 22.47 Favored 'General case' 0 CA--C 1.572 1.799 0 CA-C-O 122.429 1.109 . . . . 0.0 112.807 174.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -77.97 152.99 32.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.213 -0.929 . . . . 0.0 112.713 175.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.62 159.0 30.65 Favored 'General case' 0 CA--C 1.569 1.697 0 CA-C-O 123.972 1.844 . . . . 0.0 115.278 -174.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 56.8 mtt85 -126.53 168.13 14.69 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-N 113.475 -1.693 . . . . 0.0 110.939 -177.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -44.51 135.21 4.87 Favored 'General case' 0 CA--C 1.574 1.884 0 N-CA-C 116.953 2.205 . . . . 0.0 116.953 -173.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.39 6.6 p30 67.88 14.04 9.32 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 116.957 2.206 . . . . 0.0 116.957 -173.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.5 t -117.41 146.29 43.54 Favored 'General case' 0 CA--C 1.565 1.546 0 CA-C-O 122.867 1.318 . . . . 0.0 110.56 173.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -60.11 139.68 57.35 Favored 'General case' 0 CA--C 1.571 1.753 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.611 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 28.5 p -141.88 150.74 41.93 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 113.289 -1.778 . . . . 0.0 114.692 -174.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.8 t -79.83 109.67 14.47 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 173.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.03 -43.46 64.95 Favored 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -105.23 144.71 31.64 Favored 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 170.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 22.3 p -126.79 139.03 53.41 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.196 -1.565 . . . . 0.0 112.295 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -98.39 -169.24 1.77 Allowed 'General case' 0 CA--C 1.576 1.965 0 CA-C-N 113.098 -1.864 . . . . 0.0 109.513 173.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -103.22 62.53 0.79 Allowed 'General case' 0 N--CA 1.499 2.016 0 CA-C-O 123.258 1.504 . . . . 0.0 108.017 174.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -162.61 177.4 38.74 Favored Glycine 0 N--CA 1.475 1.272 0 CA-C-N 113.554 -1.657 . . . . 0.0 112.012 -174.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.46 HG12 ' HB2' ' A' ' 30' ' ' HIS . 3.4 t -78.34 141.06 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 CA-C-O 123.396 1.569 . . . . 0.0 111.764 -167.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -107.54 136.53 47.16 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 114.165 -1.38 . . . . 0.0 112.964 -172.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -68.41 -19.94 64.63 Favored 'General case' 0 CA--C 1.592 2.572 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 172.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.67 111.97 1.21 Allowed 'General case' 0 CA--C 1.575 1.925 0 C-N-CA 128.038 2.535 . . . . 0.0 104.837 -175.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 40.2 m -58.64 155.49 29.34 Favored Pre-proline 0 CA--C 1.588 2.442 0 O-C-N 118.946 -2.346 . . . . 0.0 116.75 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -64.2 168.59 12.24 Favored 'Trans proline' 0 CA--C 1.573 2.434 0 C-N-CA 122.691 2.26 . . . . 0.0 115.678 175.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 60.9 m -73.94 150.26 40.91 Favored 'General case' 0 CA--C 1.575 1.94 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -177.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.71 -175.96 1.84 Allowed 'General case' 0 CA--C 1.583 2.23 0 N-CA-C 116.97 2.211 . . . . 0.0 116.97 -174.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.46 114.38 1.99 Allowed 'General case' 0 CA--C 1.572 1.826 0 O-C-N 120.474 -1.391 . . . . 0.0 114.306 -179.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 80.83 15.61 77.17 Favored Glycine 0 N--CA 1.493 2.489 0 N-CA-C 119.43 2.532 . . . . 0.0 119.43 -174.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 tt -132.75 132.46 42.31 Favored 'General case' 0 CA--C 1.568 1.641 0 CA-C-N 119.024 1.412 . . . . 0.0 108.267 -174.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.07 158.06 15.77 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -173.367 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 16.0 t -94.54 111.56 23.32 Favored 'General case' 0 CA--C 1.568 1.671 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.907 172.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -97.0 105.44 17.59 Favored 'General case' 0 CA--C 1.567 1.619 0 O-C-N 120.452 -1.405 . . . . 0.0 110.818 -175.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -71.78 76.65 0.68 Allowed Glycine 0 N--CA 1.495 2.569 0 N-CA-C 116.641 1.416 . . . . 0.0 116.641 -177.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -124.39 -37.33 2.54 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 115.777 1.769 . . . . 0.0 115.777 -176.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -92.11 82.1 5.05 Favored 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 122.029 2.195 . . . . 0.0 112.282 -177.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 53.6 p -102.31 65.81 0.97 Allowed 'General case' 0 CA--C 1.57 1.727 0 CA-C-O 122.663 1.221 . . . . 0.0 111.847 174.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 48.8 tp -91.23 90.49 7.79 Favored 'General case' 0 CA--C 1.564 1.511 0 C-N-CA 124.702 1.201 . . . . 0.0 109.17 174.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.1 p -53.79 -33.89 24.06 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.394 0 N-CA-C 118.307 2.706 . . . . 0.0 118.307 -174.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -85.68 74.23 2.46 Favored Glycine 0 N--CA 1.495 2.578 0 CA-C-N 119.381 0.991 . . . . 0.0 113.999 174.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.6 t -149.24 165.75 30.94 Favored 'General case' 0 CA--C 1.57 1.749 0 CA-C-O 122.045 0.926 . . . . 0.0 112.572 -170.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.402 ' CD1' ' H ' ' A' ' 80' ' ' THR . 1.3 pp -76.49 -77.07 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.146 0 O-C-N 120.801 -1.187 . . . . 0.0 112.002 177.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.402 ' H ' ' CD1' ' A' ' 79' ' ' ILE 0.251 14.5 t -134.63 43.66 2.73 Favored 'General case' 0 N--CA 1.517 2.889 0 CA-C-O 126.129 2.871 . . . . 0.0 117.113 175.233 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -145.51 68.99 1.22 Allowed 'General case' 0 CA--C 1.57 1.731 0 CA-C-N 109.866 -3.334 . . . . 0.0 102.376 170.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 16.0 p -99.76 -79.13 0.49 Allowed 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.859 0.864 . . . . 0.0 109.863 -170.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -124.45 66.98 1.07 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 120.336 -1.477 . . . . 0.0 109.173 173.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -134.0 179.77 6.05 Favored 'General case' 0 CA--C 1.574 1.902 0 CA-C-O 122.628 1.204 . . . . 0.0 112.82 -173.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -102.41 169.58 19.65 Favored Glycine 0 N--CA 1.489 2.213 0 O-C-N 120.705 -1.247 . . . . 0.0 115.373 174.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 35.5 mm -110.54 135.46 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 173.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.611 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 23.1 m -63.2 131.1 47.3 Favored 'General case' 0 CA--C 1.57 1.748 0 O-C-N 120.528 -1.357 . . . . 0.0 114.352 173.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 -144.6 148.27 34.15 Favored 'General case' 0 CA--C 1.563 1.48 0 O-C-N 120.731 -1.23 . . . . 0.0 109.718 173.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -96.87 130.18 44.2 Favored 'General case' 0 CA--C 1.565 1.55 0 O-C-N 120.692 -1.255 . . . . 0.0 109.835 176.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 61.8 t -93.53 -59.06 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.098 -174.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -145.63 61.97 0.47 Allowed Glycine 0 N--CA 1.494 2.512 0 O-C-N 121.528 -0.733 . . . . 0.0 114.672 174.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 31.4 ttm180 65.76 -75.15 0.05 Allowed 'General case' 0 N--CA 1.5 2.042 0 C-N-CA 125.376 1.471 . . . . 0.0 113.092 -175.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.0 t . . . . . 0 CA--C 1.565 1.532 0 CA-C-O 123.71 1.719 . . . . 0.0 113.247 176.933 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 CA--C 1.586 2.347 0 CA-C-O 114.472 -2.68 . . . . 0.0 116.571 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -77.21 82.65 2.31 Favored 'Trans proline' 0 CA--C 1.57 2.322 0 CA-C-N 127.829 3.832 . . . . 0.0 115.372 -175.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -91.6 129.51 42.44 Favored Pre-proline 0 CA--C 1.584 2.287 0 CA-C-O 117.188 -1.387 . . . . 0.0 111.458 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -44.75 -31.02 4.67 Favored 'Trans proline' 0 N--CA 1.503 2.062 1 N-CA-C 122.518 4.007 . . . . 0.0 122.518 -175.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -12.28 51.92 Favored 'General case' 0 CA--C 1.581 2.161 0 N-CA-C 117.407 2.373 . . . . 0.0 117.407 174.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 103.39 25.37 7.4 Favored Glycine 0 N--CA 1.497 2.731 0 N-CA-C 119.57 2.588 . . . . 0.0 119.57 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . 0.319 48.9 mt 65.86 -73.3 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.143 0 C-N-CA 126.571 1.949 . . . . 0.0 112.902 175.394 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 71.8 mt -134.2 102.0 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 5.7 pt -116.91 -129.05 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.196 0 O-C-N 121.764 -0.585 . . . . 0.0 111.056 -175.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 85.72 87.41 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 126.733 2.013 . . . . 0.0 114.327 174.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -138.08 155.07 49.14 Favored 'General case' 0 CA--C 1.574 1.873 0 CA-C-O 122.401 1.096 . . . . 0.0 110.074 172.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -78.11 164.09 25.3 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 119.376 -2.077 . . . . 0.0 114.732 -173.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -73.91 150.18 41.01 Favored 'General case' 0 CA--C 1.573 1.854 0 CA-C-O 122.239 1.019 . . . . 0.0 110.606 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.59 24.76 34.96 Favored Glycine 0 CA--C 1.562 3.027 0 O-C-N 121.484 -0.76 . . . . 0.0 114.819 -170.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -132.95 143.57 49.55 Favored 'General case' 0 CA--C 1.569 1.699 0 C-N-CA 125.632 1.573 . . . . 0.0 108.763 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 34.9 mt -70.92 134.19 47.04 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -174.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.7 p -140.48 152.68 45.81 Favored 'General case' 0 CA--C 1.561 1.373 0 C-N-CA 124.002 0.921 . . . . 0.0 113.124 -174.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -85.4 -77.88 0.28 Allowed 'General case' 0 CA--C 1.567 1.616 0 CA-C-O 117.743 -1.122 . . . . 0.0 108.222 172.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -96.35 170.75 9.02 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 121.149 1.795 . . . . 0.0 114.114 174.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.8 m -69.4 -10.69 59.07 Favored 'General case' 0 N--CA 1.508 2.451 0 N-CA-C 117.077 2.251 . . . . 0.0 117.077 174.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.41 52.82 2.56 Favored 'General case' 0 CA--C 1.571 1.764 0 CA-C-O 123.554 1.645 . . . . 0.0 114.939 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -141.32 -49.59 0.41 Allowed 'General case' 0 CA--C 1.574 1.878 0 CA-C-N 113.968 -1.469 . . . . 0.0 113.98 -177.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 67.4 m -84.19 160.92 20.73 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 116.15 1.907 . . . . 0.0 116.15 -174.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -60.53 -54.24 47.79 Favored 'General case' 0 N--CA 1.504 2.232 0 C-N-CA 124.754 1.222 . . . . 0.0 109.112 171.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.8 t -82.64 92.25 7.12 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 102.07 -3.307 . . . . 0.0 102.07 167.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -72.75 69.19 0.9 Allowed 'General case' 0 N--CA 1.497 1.922 0 CA-C-O 124.64 2.162 . . . . 0.0 116.435 -170.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 43.9 t -145.44 96.39 2.82 Favored 'General case' 0 CA--C 1.557 1.225 0 CA-C-N 112.643 -2.071 . . . . 0.0 110.155 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 15.6 t -78.08 115.08 17.55 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 103.802 -2.666 . . . . 0.0 103.802 171.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -98.84 123.7 43.26 Favored 'General case' 0 CA--C 1.566 1.56 0 CA-C-O 123.156 1.455 . . . . 0.0 114.538 -170.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.55 ' HB2' HG12 ' A' ' 57' ' ' VAL . 12.2 t-80 -87.23 116.77 25.54 Favored 'General case' 0 CA--C 1.562 1.418 0 CA-C-N 114.026 -1.443 . . . . 0.0 113.603 -174.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -83.42 56.35 3.54 Favored 'General case' 0 CA--C 1.581 2.143 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 174.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 17.7 p 77.18 109.73 0.07 Allowed 'General case' 0 N--CA 1.505 2.308 0 N-CA-C 119.454 3.131 . . . . 0.0 119.454 171.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.302 4.7 mp 53.52 -87.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 C-N-CA 126.79 2.036 . . . . 0.0 115.766 172.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.7 tp -103.37 88.1 3.03 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 175.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 54.4 p -136.2 150.5 49.04 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 116.303 1.964 . . . . 0.0 116.303 -172.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 46.2 tp -80.37 117.09 20.81 Favored 'General case' 0 CA--C 1.569 1.709 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 173.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.9 m -92.6 137.2 32.57 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 122.964 1.364 . . . . 0.0 114.515 -171.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.8 ttt180 -134.53 137.35 43.76 Favored 'General case' 0 N--CA 1.495 1.8 0 C-N-CA 124.055 0.942 . . . . 0.0 110.181 -174.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 67.1 m -65.98 148.23 52.12 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 119.606 -1.934 . . . . 0.0 114.946 -177.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.67 -179.47 5.94 Favored 'General case' 0 CA--C 1.57 1.74 0 CA-C-N 113.488 -1.687 . . . . 0.0 112.83 -174.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.2 mt -81.65 138.91 35.24 Favored 'General case' 0 CA--C 1.566 1.579 0 O-C-N 121.069 -1.02 . . . . 0.0 112.932 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.9 pttt -70.67 134.5 47.58 Favored 'General case' 0 CA--C 1.573 1.852 0 O-C-N 121.606 -0.684 . . . . 0.0 110.3 173.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.41 154.73 38.66 Favored 'General case' 0 CA--C 1.561 1.389 0 N-CA-C 118.37 2.73 . . . . 0.0 118.37 -171.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -113.09 171.73 7.37 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 112.569 -2.105 . . . . 0.0 112.722 -177.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -58.94 125.01 21.79 Favored 'General case' 0 CA--C 1.568 1.669 0 CA-C-N 114.838 -1.073 . . . . 0.0 113.009 -174.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 85.51 18.22 0.12 Allowed 'General case' 0 CA--C 1.586 2.338 0 C-N-CA 125.956 1.702 . . . . 0.0 114.177 -173.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.3 t -119.77 151.79 38.24 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 119.953 -1.717 . . . . 0.0 112.312 175.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -74.51 120.71 20.44 Favored 'General case' 0 CA--C 1.575 1.918 0 CA-C-O 123.755 1.74 . . . . 0.0 112.534 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.495 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 19.3 p -122.86 152.53 40.66 Favored 'General case' 0 CA--C 1.562 1.426 0 C-N-CA 127.146 2.178 . . . . 0.0 112.482 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 65.9 m -75.57 123.4 25.43 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.403 -1.436 . . . . 0.0 107.804 173.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.82 -49.33 25.73 Favored 'General case' 0 CA--C 1.565 1.525 0 N-CA-C 116.884 2.179 . . . . 0.0 116.884 -172.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -91.97 151.84 20.31 Favored 'General case' 0 CA--C 1.566 1.591 0 CA-C-N 118.758 0.708 . . . . 0.0 109.867 173.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.6 p -121.0 146.58 46.54 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 124.411 2.053 . . . . 0.0 110.588 174.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -98.47 -126.29 0.16 Allowed 'General case' 0 CA--C 1.569 1.711 0 CA-C-N 112.469 -2.15 . . . . 0.0 105.884 174.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -149.17 70.83 1.1 Allowed 'General case' 0 CA--C 1.564 1.511 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 169.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 175.47 -135.78 3.14 Favored Glycine 0 N--CA 1.483 1.819 0 CA-C-N 115.644 -0.707 . . . . 0.0 113.999 -176.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.55 HG12 ' HB2' ' A' ' 30' ' ' HIS . 3.4 t -79.76 144.22 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.175 0 CA-C-O 122.25 1.024 . . . . 0.0 112.196 -172.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -123.6 135.84 54.18 Favored 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 123.515 0.726 . . . . 0.0 112.56 -173.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -60.42 -51.08 71.02 Favored 'General case' 0 N--CA 1.503 2.218 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 177.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -135.41 122.02 20.79 Favored 'General case' 0 CA--C 1.559 1.311 0 N-CA-C 103.892 -2.633 . . . . 0.0 103.892 174.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 97.2 m -43.91 130.66 4.2 Favored Pre-proline 0 CA--C 1.592 2.588 0 N-CA-C 117.852 2.538 . . . . 0.0 117.852 -174.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -77.65 60.75 7.28 Favored 'Trans proline' 0 CA--C 1.576 2.614 0 C-N-CA 123.179 2.586 . . . . 0.0 118.637 -173.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 37.8 m 61.7 163.92 0.08 Allowed 'General case' 0 CA--C 1.582 2.198 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.42 174.07 11.83 Favored 'General case' 0 CA--C 1.575 1.94 0 N-CA-C 115.19 1.552 . . . . 0.0 115.19 178.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.99 108.65 1.26 Allowed 'General case' 0 CA--C 1.574 1.868 0 O-C-N 120.476 -1.39 . . . . 0.0 112.469 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 93.18 27.7 13.07 Favored Glycine 0 N--CA 1.497 2.709 0 N-CA-C 118.036 1.974 . . . . 0.0 118.036 -173.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 12.3 tp -140.9 138.42 33.87 Favored 'General case' 0 CA--C 1.567 1.614 0 CA-C-N 118.794 1.297 . . . . 0.0 110.225 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -98.74 154.1 18.23 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.708 -1.245 . . . . 0.0 112.828 -176.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.2 t -94.77 146.62 24.06 Favored 'General case' 0 CA--C 1.575 1.911 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.943 172.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -97.6 -115.17 0.14 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 120.381 -1.449 . . . . 0.0 110.378 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 179.49 100.98 0.14 Allowed Glycine 0 N--CA 1.492 2.398 0 CA-C-N 122.33 2.332 . . . . 0.0 116.199 -176.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -96.16 -84.4 0.35 Allowed 'General case' 0 CA--C 1.578 2.044 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 171.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.88 159.59 36.94 Favored 'General case' 0 CA--C 1.574 1.882 0 C-N-CA 125.33 1.452 . . . . 0.0 110.056 176.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 58.8 p -154.46 -80.71 0.09 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.079 -1.638 . . . . 0.0 111.436 174.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 74.94 76.2 0.11 Allowed 'General case' 0 CA--C 1.581 2.166 0 C-N-CA 125.883 1.673 . . . . 0.0 113.569 -178.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . 0.355 3.9 p 50.38 -62.12 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.287 0 N-CA-C 121.041 3.719 . . . . 0.0 121.041 174.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 164.34 -58.62 0.26 Allowed Glycine 0 N--CA 1.494 2.541 0 N-CA-C 116.905 1.522 . . . . 0.0 116.905 -176.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.6 t -75.05 -12.35 60.3 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 118.914 2.931 . . . . 0.0 118.914 -177.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 43.6 mm -109.57 -77.19 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.172 0 N-CA-C 106.884 -1.525 . . . . 0.0 106.884 174.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.253 43.7 p 68.16 146.6 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 117.766 2.506 . . . . 0.0 117.766 174.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -117.16 117.0 28.4 Favored 'General case' 0 CA--C 1.565 1.524 0 N-CA-C 101.939 -3.356 . . . . 0.0 101.939 172.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 41.1 p -90.41 69.04 6.9 Favored 'General case' 0 N--CA 1.503 2.184 0 CA-C-O 126.736 3.16 . . . . 0.0 115.079 -171.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -145.23 85.0 1.72 Allowed 'General case' 0 CA--C 1.564 1.513 0 CA-C-N 109.272 -3.604 . . . . 0.0 105.882 173.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -93.85 167.1 11.85 Favored 'General case' 0 CA--C 1.574 1.902 0 O-C-N 120.609 -1.307 . . . . 0.0 112.324 -174.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.22 162.33 23.85 Favored Glycine 0 N--CA 1.495 2.576 0 N-CA-C 119.116 2.406 . . . . 0.0 119.116 -174.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 23.2 mm -95.96 136.76 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 O-C-N 120.975 -1.309 . . . . 0.0 110.774 -171.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.495 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 53.2 m -67.85 124.22 22.72 Favored 'General case' 0 CA--C 1.569 1.691 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 174.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -144.12 159.79 42.04 Favored 'General case' 0 CA--C 1.565 1.525 0 CA-C-O 123.328 1.537 . . . . 0.0 111.642 174.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -99.44 132.64 44.63 Favored 'General case' 0 CA--C 1.564 1.512 0 O-C-N 120.855 -1.153 . . . . 0.0 110.7 175.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 59.9 t -106.83 5.64 9.99 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.43 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -179.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.15 -50.5 66.57 Favored Glycine 0 N--CA 1.497 2.765 0 O-C-N 119.132 -2.23 . . . . 0.0 118.358 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 52.6 ttp180 -86.03 81.96 8.28 Favored 'General case' 0 CA--C 1.572 1.798 0 CA-C-N 118.08 0.94 . . . . 0.0 110.346 173.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 94.6 p . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 123.329 1.537 . . . . 0.0 110.676 -175.778 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 14.0 m . . . . . 0 CA--C 1.578 2.044 0 CA-C-O 118.411 -0.804 . . . . 0.0 110.569 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -80.63 73.42 6.03 Favored 'Trans proline' 0 CA--C 1.572 2.389 0 CA-C-N 123.015 2.112 . . . . 0.0 114.67 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -101.9 114.97 65.39 Favored Pre-proline 0 CA--C 1.578 2.046 0 CA-C-O 118.103 -0.951 . . . . 0.0 111.297 -175.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -79.8 88.57 1.42 Allowed 'Trans proline' 0 CA--C 1.571 2.341 0 CA-C-N 123.051 2.125 . . . . 0.0 114.383 -178.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -78.23 -22.13 48.9 Favored 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -177.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 86.97 -56.48 4.63 Favored Glycine 0 N--CA 1.499 2.864 0 CA-C-N 121.54 1.973 . . . . 0.0 116.272 -174.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 63.9 mt -70.38 -47.25 67.21 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.174 0 C-N-CA 123.801 0.841 . . . . 0.0 111.76 170.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 62.8 mt -83.25 86.83 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 CA-C-N 120.052 1.296 . . . . 0.0 108.782 178.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.474 HG13 ' H ' ' A' ' 10' ' ' ASN . 7.8 pt -121.88 -85.68 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 C-N-CA 123.976 0.91 . . . . 0.0 109.056 -179.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.474 ' H ' HG13 ' A' ' 9' ' ' ILE . 0.8 OUTLIER 47.93 82.48 0.04 OUTLIER 'General case' 0 CA--C 1.58 2.128 0 N-CA-C 118.017 2.599 . . . . 0.0 118.017 174.156 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 mt -131.54 146.48 52.24 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 123.568 1.651 . . . . 0.0 113.838 175.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -80.51 162.6 24.27 Favored 'General case' 0 CA--C 1.567 1.616 0 CA-C-N 114.193 -1.367 . . . . 0.0 113.47 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -76.72 131.78 38.95 Favored 'General case' 0 CA--C 1.578 2.041 0 N-CA-C 107.788 -1.189 . . . . 0.0 107.788 173.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 101.66 26.7 7.48 Favored Glycine 0 CA--C 1.561 2.948 0 CA-C-N 115.766 -0.652 . . . . 0.0 114.469 -171.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -129.24 139.46 51.83 Favored 'General case' 0 CA--C 1.566 1.574 0 C-N-CA 125.121 1.368 . . . . 0.0 109.243 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.0 mp -68.08 124.96 24.86 Favored 'General case' 0 CA--C 1.574 1.868 0 O-C-N 121.152 -0.967 . . . . 0.0 112.191 -178.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 6.8 p -131.39 152.1 50.94 Favored 'General case' 0 CA--C 1.561 1.399 0 C-N-CA 124.229 1.011 . . . . 0.0 113.072 -174.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 97.7 mt -84.09 -74.97 0.36 Allowed 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 118.092 -0.956 . . . . 0.0 108.917 174.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -98.57 172.93 7.18 Favored 'General case' 0 N--CA 1.501 2.09 0 CA-C-N 120.998 1.726 . . . . 0.0 113.331 173.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.9 m -71.92 -9.67 58.68 Favored 'General case' 0 N--CA 1.508 2.463 0 N-CA-C 116.639 2.089 . . . . 0.0 116.639 173.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.72 4.2 12.18 Favored 'General case' 0 CA--C 1.572 1.816 0 N-CA-C 118.27 2.693 . . . . 0.0 118.27 176.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -97.77 -35.59 10.49 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 115.346 1.609 . . . . 0.0 115.346 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 71.4 m -81.05 155.77 26.17 Favored 'General case' 0 CA--C 1.564 1.498 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 177.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -62.96 -50.9 68.98 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.385 -0.822 . . . . 0.0 110.089 172.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.0 p -82.46 97.39 8.38 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 102.851 -3.018 . . . . 0.0 102.851 167.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -70.85 80.55 0.63 Allowed 'General case' 0 N--CA 1.498 1.94 0 CA-C-O 124.6 2.143 . . . . 0.0 115.354 -171.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 41.0 t -158.28 93.12 1.2 Allowed 'General case' 0 CA--C 1.557 1.218 0 CA-C-N 112.248 -2.251 . . . . 0.0 110.699 -176.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.8 t -80.22 113.98 18.79 Favored 'General case' 0 CA--C 1.56 1.348 0 N-CA-C 104.933 -2.247 . . . . 0.0 104.933 171.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 46.7 tp60 -91.99 115.79 28.37 Favored 'General case' 0 CA--C 1.558 1.287 0 CA-C-O 122.347 1.07 . . . . 0.0 113.884 -172.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.515 ' HB2' HG12 ' A' ' 57' ' ' VAL . 24.3 t-80 -81.1 117.28 21.54 Favored 'General case' 0 CA--C 1.562 1.432 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.734 176.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -72.15 56.83 0.34 Allowed 'General case' 0 CA--C 1.581 2.163 0 N-CA-C 116.923 2.194 . . . . 0.0 116.923 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 44.3 p 61.25 69.13 0.68 Allowed 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 126.037 1.735 . . . . 0.0 115.071 173.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.331 3.7 mp 71.1 -32.84 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.534 0 C-N-CA 125.191 1.396 . . . . 0.0 113.762 -179.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.1 tp -53.07 -20.95 4.06 Favored 'General case' 0 CA--C 1.586 2.364 0 N-CA-C 117.627 2.454 . . . . 0.0 117.627 174.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.288 26.3 p 77.93 1.44 2.83 Favored 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 121.692 3.96 . . . . 0.0 121.692 172.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.5 tp -73.64 96.25 2.45 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 121.711 2.05 . . . . 0.0 106.76 172.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.9 m -97.68 107.37 19.85 Favored 'General case' 0 CA--C 1.56 1.344 0 CA-C-O 123.139 1.447 . . . . 0.0 111.648 -171.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -131.22 132.83 44.93 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-N 114.546 -1.206 . . . . 0.0 108.98 -174.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 99.5 m -62.42 150.56 39.53 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 122.402 2.365 . . . . 0.0 116.504 -174.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -132.61 173.41 11.36 Favored 'General case' 0 CA--C 1.568 1.658 0 CA-C-N 114.162 -1.381 . . . . 0.0 113.842 -174.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 26.6 tp -85.47 146.19 27.07 Favored 'General case' 0 CA--C 1.569 1.677 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -174.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -69.95 143.32 52.7 Favored 'General case' 0 CA--C 1.577 2.001 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 175.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.492 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . . . -78.93 169.61 17.96 Favored 'General case' 0 CA--C 1.579 2.077 0 N-CA-C 118.272 2.694 . . . . 0.0 118.272 -173.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 46.3 mtp180 -112.66 173.87 6.17 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 113.19 -1.823 . . . . 0.0 112.57 -178.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -64.2 136.76 57.51 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 122.083 0.944 . . . . 0.0 113.134 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 70.98 23.31 4.29 Favored 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 124.93 1.292 . . . . 0.0 114.118 -173.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.9 t -121.87 148.54 44.59 Favored 'General case' 0 CA--C 1.558 1.266 0 CA-C-O 122.596 1.189 . . . . 0.0 110.263 174.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -67.53 133.49 49.56 Favored 'General case' 0 CA--C 1.576 1.953 0 CA-C-O 123.749 1.738 . . . . 0.0 112.137 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 87' ' ' CYS . 22.3 p -137.41 156.43 48.2 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 112.855 -1.975 . . . . 0.0 112.552 -174.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 92.9 p -81.64 117.57 22.1 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 172.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.36 -55.31 7.3 Favored 'General case' 0 CA--C 1.583 2.244 0 CA-C-O 122.813 1.292 . . . . 0.0 108.181 172.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -155.24 127.64 7.82 Favored 'General case' 0 CA--C 1.573 1.838 0 N-CA-C 101.795 -3.409 . . . . 0.0 101.795 169.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.4 m -88.39 -70.43 0.64 Allowed 'General case' 0 CA--C 1.568 1.651 0 O-C-N 119.434 -2.042 . . . . 0.0 106.125 171.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -152.59 -72.67 0.14 Allowed 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 124.694 1.198 . . . . 0.0 109.816 173.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -162.43 -43.45 0.04 OUTLIER 'General case' 0 CA--C 1.579 2.084 0 C-N-CA 125.128 1.371 . . . . 0.0 113.851 -173.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -96.95 -120.44 3.94 Favored Glycine 0 N--CA 1.485 1.942 0 N-CA-C 116.94 1.536 . . . . 0.0 116.94 -172.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.515 HG12 ' HB2' ' A' ' 30' ' ' HIS . 3.1 t -82.16 141.04 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 CA-C-O 122.415 1.102 . . . . 0.0 111.11 -175.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 17.0 m-30 -122.65 148.84 44.79 Favored 'General case' 0 CA--C 1.559 1.317 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 -171.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -77.97 -9.05 58.91 Favored 'General case' 0 CA--C 1.585 2.311 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 173.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.61 140.04 9.45 Favored 'General case' 0 CA--C 1.571 1.752 0 C-N-CA 126.68 1.992 . . . . 0.0 106.686 -174.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 96.3 m -82.64 156.26 68.13 Favored Pre-proline 0 CA--C 1.581 2.135 0 N-CA-C 116.706 2.113 . . . . 0.0 116.706 177.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.51 171.52 16.96 Favored 'Trans proline' 0 CA--C 1.571 2.361 0 C-N-CA 122.704 2.269 . . . . 0.0 112.989 173.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.492 ' SG ' ' HB3' ' A' ' 43' ' ' ALA . 5.3 m -85.85 170.07 12.74 Favored 'General case' 0 CA--C 1.568 1.666 0 CA-C-O 123.751 1.739 . . . . 0.0 115.042 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -59.73 154.68 17.53 Favored 'General case' 0 CA--C 1.572 1.824 0 N-CA-C 115.805 1.78 . . . . 0.0 115.805 178.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -65.62 113.37 4.18 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 122.62 1.2 . . . . 0.0 112.427 -174.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 115.43 -27.08 8.66 Favored Glycine 0 N--CA 1.497 2.756 0 CA-C-N 114.099 -1.41 . . . . 0.0 116.355 -172.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 11.7 tp -97.42 138.81 34.29 Favored 'General case' 0 CA--C 1.569 1.688 0 CA-C-N 118.504 1.152 . . . . 0.0 110.936 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -97.19 148.82 22.69 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.424 -1.423 . . . . 0.0 113.443 -174.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 16.7 t -94.37 100.82 12.78 Favored 'General case' 0 CA--C 1.569 1.681 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.094 173.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -97.23 107.99 20.63 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 120.587 1.54 . . . . 0.0 111.66 -176.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 142.65 123.55 1.83 Allowed Glycine 0 N--CA 1.483 1.782 0 CA-C-O 122.244 0.913 . . . . 0.0 113.261 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -117.55 151.91 36.18 Favored 'General case' 0 CA--C 1.572 1.82 0 CA-C-O 122.315 1.055 . . . . 0.0 109.764 165.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . 0.301 11.5 tmtt? 68.91 -94.03 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 125.351 1.46 . . . . 0.0 109.302 -173.218 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.7 t 59.91 110.06 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 117.683 2.475 . . . . 0.0 117.683 173.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -63.45 -32.91 74.49 Favored 'General case' 0 CA--C 1.584 2.263 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 172.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 91.8 t -77.68 92.8 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.573 1.836 0 O-C-N 120.774 -1.204 . . . . 0.0 107.865 174.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -147.49 -115.33 0.85 Allowed Glycine 0 N--CA 1.483 1.816 0 CA-C-N 115.034 -0.984 . . . . 0.0 114.083 -178.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.4 t -142.52 -67.59 0.37 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 122.26 -0.553 . . . . 0.0 112.351 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 11.6 tt -149.35 136.5 13.33 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.484 0 CA-C-O 123.087 1.422 . . . . 0.0 107.96 176.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.252 0.7 OUTLIER 63.56 158.8 0.08 Allowed 'General case' 0 N--CA 1.502 2.136 0 CA-C-O 123.243 1.497 . . . . 0.0 114.482 -174.727 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -97.57 68.93 2.16 Favored 'General case' 0 CA--C 1.569 1.703 0 O-C-N 120.959 -1.088 . . . . 0.0 112.583 -176.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . 0.297 4.3 t -97.17 -93.42 0.22 Allowed 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 117.634 -1.174 . . . . 0.0 111.011 -175.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -151.45 87.74 1.39 Allowed 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 121.719 2.054 . . . . 0.0 111.678 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -108.82 154.53 21.95 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 123.079 1.418 . . . . 0.0 110.159 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -166.18 154.73 25.5 Favored Glycine 0 N--CA 1.488 2.165 0 O-C-N 121.075 -1.016 . . . . 0.0 112.936 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.7 mm -94.19 138.43 20.59 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.161 0 CA-C-N 119.44 1.62 . . . . 0.0 109.188 -176.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 61.2 m -74.73 123.41 24.88 Favored 'General case' 0 CA--C 1.563 1.461 0 N-CA-C 116.177 1.917 . . . . 0.0 116.177 178.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -141.11 158.62 43.66 Favored 'General case' 0 CA--C 1.561 1.373 0 CA-C-O 123.488 1.614 . . . . 0.0 111.483 179.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -98.15 40.7 1.16 Allowed 'General case' 0 CA--C 1.581 2.168 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 174.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.0 t 48.95 71.85 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 C-N-CA 127.012 2.125 . . . . 0.0 113.811 174.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -81.0 70.26 3.1 Favored Glycine 0 N--CA 1.493 2.488 0 N-CA-C 115.865 1.106 . . . . 0.0 115.865 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 29.9 mmm180 60.48 66.14 0.97 Allowed 'General case' 0 N--CA 1.501 2.111 0 C-N-CA 124.994 1.318 . . . . 0.0 113.738 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 38.5 t . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 123.963 1.839 . . . . 0.0 114.645 -174.865 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 13.1 m . . . . . 0 CA--C 1.581 2.164 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.63 -35.21 6.25 Favored 'Trans proline' 0 CA--C 1.57 2.319 0 N-CA-C 117.741 2.169 . . . . 0.0 117.741 -178.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -116.36 99.78 52.98 Favored Pre-proline 0 CA--C 1.579 2.075 0 CA-C-N 119.355 0.98 . . . . 0.0 109.763 176.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -63.76 128.78 22.97 Favored 'Trans proline' 0 CA--C 1.567 2.162 0 C-N-CA 122.642 2.228 . . . . 0.0 115.502 176.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -77.74 34.11 0.18 Allowed 'General case' 0 CA--C 1.579 2.082 0 N-CA-C 118.542 2.793 . . . . 0.0 118.542 -174.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 53.19 40.82 60.35 Favored Glycine 0 N--CA 1.5 2.967 0 N-CA-C 120.196 2.838 . . . . 0.0 120.196 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . 0.332 1.1 tt 46.95 14.94 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.586 2.347 0 N-CA-C 120.705 3.594 . . . . 0.0 120.705 -177.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.25 21.8 pt 39.72 78.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.512 2.65 0 C-N-CA 125.896 1.678 . . . . 0.0 115.476 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.0 pt -91.46 136.94 23.0 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 CA-C-O 123.512 1.625 . . . . 0.0 112.138 -173.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 55.7 m-80 -146.63 70.85 1.22 Allowed 'General case' 0 CA--C 1.573 1.853 0 CA-C-N 113.811 -1.54 . . . . 0.0 113.792 -174.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mp -131.0 136.44 48.51 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.21 -1.557 . . . . 0.0 112.226 174.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -84.97 172.41 11.35 Favored 'General case' 0 CA--C 1.572 1.814 0 O-C-N 121.365 -0.835 . . . . 0.0 112.887 174.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -77.01 114.54 15.92 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 173.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 135.25 -8.97 4.41 Favored Glycine 0 CA--C 1.56 2.883 0 CA-C-N 114.298 -1.319 . . . . 0.0 115.627 -172.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -114.76 154.65 28.14 Favored 'General case' 0 CA--C 1.569 1.675 0 CA-C-N 120.084 1.942 . . . . 0.0 112.162 -177.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -81.83 147.95 29.1 Favored 'General case' 0 CA--C 1.574 1.866 0 CA-C-O 122.114 0.959 . . . . 0.0 113.303 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.6 p -137.55 -179.03 5.5 Favored 'General case' 0 CA--C 1.575 1.906 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -174.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.6 tp -99.29 -74.14 0.6 Allowed 'General case' 0 CA--C 1.58 2.121 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 171.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -94.87 -173.15 2.9 Favored 'General case' 0 N--CA 1.501 2.12 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 174.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.8 m -78.05 -31.93 50.59 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 119.79 -1.819 . . . . 0.0 114.703 172.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.83 65.43 4.99 Favored 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 124.706 2.193 . . . . 0.0 111.608 173.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -139.96 -50.17 0.48 Allowed 'General case' 0 CA--C 1.566 1.584 0 CA-C-N 111.89 -2.414 . . . . 0.0 111.258 -174.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 95.4 m -81.27 140.8 34.64 Favored 'General case' 0 CA--C 1.564 1.518 0 O-C-N 121.162 -0.961 . . . . 0.0 109.997 173.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -53.35 -30.3 38.69 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 118.694 2.85 . . . . 0.0 118.694 -173.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -79.78 -76.68 0.21 Allowed 'General case' 0 CA--C 1.574 1.879 0 CA-C-N 118.219 0.463 . . . . 0.0 110.516 173.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -173.07 -39.67 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.35 0 N-CA-C 116.565 2.061 . . . . 0.0 116.565 -176.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.3 t -97.71 110.52 23.07 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 119.711 3.226 . . . . 0.0 119.711 -169.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 22.5 t -95.41 118.87 32.93 Favored 'General case' 0 CA--C 1.562 1.409 0 N-CA-C 104.436 -2.431 . . . . 0.0 104.436 168.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.99 114.28 27.45 Favored 'General case' 0 CA--C 1.57 1.731 0 CA-C-O 123.185 1.469 . . . . 0.0 114.672 -172.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.697 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.1 t60 -82.52 155.54 24.49 Favored 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 126.432 1.893 . . . . 0.0 112.348 177.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.2 p30 -81.88 40.15 0.59 Allowed 'General case' 0 CA--C 1.587 2.396 0 O-C-N 120.434 -1.416 . . . . 0.0 114.21 172.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 48.7 p 63.54 90.02 0.08 Allowed 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 126.429 1.892 . . . . 0.0 113.68 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.301 3.2 mp 69.31 -38.04 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 174.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.3 mt -71.09 -87.41 0.02 OUTLIER 'General case' 0 CA--C 1.576 1.956 0 CA-C-N 122.405 2.366 . . . . 0.0 112.228 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 91.9 p -155.67 -131.25 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.022 0 CA-C-N 122.029 2.195 . . . . 0.0 114.005 174.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 20.7 tp 43.76 75.83 0.09 Allowed 'General case' 0 N--CA 1.502 2.125 0 C-N-CA 125.911 1.684 . . . . 0.0 115.113 -174.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.671 ' HB3' HG11 ' A' ' 57' ' ' VAL . 18.7 m -98.81 86.61 3.55 Favored 'General case' 0 CA--C 1.565 1.531 0 CA-C-O 122.205 1.002 . . . . 0.0 110.69 -174.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -120.36 127.66 52.52 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.653 1.181 . . . . 0.0 109.977 -174.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 74.8 m -66.6 140.42 57.94 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 116.281 1.956 . . . . 0.0 116.281 -174.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -142.34 173.17 11.77 Favored 'General case' 0 CA--C 1.565 1.554 0 CA-C-N 113.312 -1.767 . . . . 0.0 114.314 -173.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.6 pp -84.9 165.52 17.6 Favored 'General case' 0 CA--C 1.573 1.831 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 178.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -74.35 146.69 42.84 Favored 'General case' 0 CA--C 1.574 1.877 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.41 164.04 25.84 Favored 'General case' 0 CA--C 1.571 1.761 0 N-CA-C 115.67 1.73 . . . . 0.0 115.67 -174.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 65.3 mtt180 -128.87 165.28 21.34 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 122.556 1.17 . . . . 0.0 112.338 -175.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -43.09 126.77 4.08 Favored 'General case' 0 CA--C 1.568 1.656 0 N-CA-C 117.3 2.333 . . . . 0.0 117.3 -172.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 72.39 17.97 4.66 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 115.248 1.573 . . . . 0.0 115.248 -174.09 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.7 t -117.75 150.32 39.3 Favored 'General case' 0 CA--C 1.565 1.533 0 CA-C-O 122.758 1.266 . . . . 0.0 110.619 174.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -65.33 122.0 16.12 Favored 'General case' 0 CA--C 1.573 1.85 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 -175.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.422 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 4.6 t -113.03 137.34 51.56 Favored 'General case' 0 CA--C 1.558 1.275 0 CA-C-N 113.489 -1.687 . . . . 0.0 111.232 174.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.1 t -99.68 115.68 30.03 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 172.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.19 -22.33 45.11 Favored 'General case' 0 CA--C 1.572 1.789 0 N-CA-C 115.997 1.851 . . . . 0.0 115.997 -178.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -129.33 154.64 46.68 Favored 'General case' 0 CA--C 1.578 2.027 0 N-CA-C 117.431 2.382 . . . . 0.0 117.431 -176.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.6 t 131.47 -152.51 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.523 2 N-CA-C 97.042 -5.17 . . . . 0.0 97.042 -171.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.653 3.6 mt 176.02 -69.36 0.01 OUTLIER 'General case' 0 N--CA 1.521 3.075 1 O-C-N 113.353 -5.842 . . . . 0.0 110.608 160.858 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -78.8 -26.81 44.35 Favored 'General case' 0 CA--C 1.577 1.997 0 CA-C-N 112.433 -2.167 . . . . 0.0 108.883 168.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -81.97 159.76 40.05 Favored Glycine 0 CA--C 1.55 2.219 0 N-CA-C 107.619 -2.193 . . . . 0.0 107.619 170.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.697 HG12 ' HB2' ' A' ' 30' ' ' HIS . 93.6 t -70.87 135.67 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 CA-C-O 123.715 1.721 . . . . 0.0 112.028 -163.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 -66.7 124.23 22.3 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 113.014 -1.903 . . . . 0.0 114.779 -172.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -69.3 -40.63 77.57 Favored 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 114.787 1.402 . . . . 0.0 114.787 -174.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -149.95 103.84 3.24 Favored 'General case' 0 CA--C 1.569 1.684 0 N-CA-C 101.593 -3.484 . . . . 0.0 101.593 172.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 57.2 m -39.91 127.61 1.58 Allowed Pre-proline 0 CA--C 1.587 2.396 0 N-CA-C 116.913 2.19 . . . . 0.0 116.913 -173.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -47.83 166.33 0.12 Allowed 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 123.52 2.813 . . . . 0.0 119.266 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 58.4 m -68.01 146.09 53.86 Favored 'General case' 0 CA--C 1.569 1.686 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -178.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -178.72 1.42 Allowed 'General case' 0 CA--C 1.577 2.011 0 N-CA-C 115.268 1.581 . . . . 0.0 115.268 -176.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -60.84 112.45 2.05 Favored 'General case' 0 CA--C 1.571 1.76 0 O-C-N 120.349 -1.469 . . . . 0.0 113.096 -175.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.13 -20.65 35.17 Favored Glycine 0 N--CA 1.496 2.699 0 N-CA-C 118.629 2.212 . . . . 0.0 118.629 -173.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.1 mp -106.35 151.93 24.23 Favored 'General case' 0 CA--C 1.569 1.689 0 CA-C-N 118.841 1.32 . . . . 0.0 112.183 -178.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.96 158.26 17.87 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-O 122.368 1.08 . . . . 0.0 113.611 -176.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 6.1 t -90.71 120.04 31.43 Favored 'General case' 0 CA--C 1.57 1.745 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.526 173.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -96.34 -135.06 0.23 Allowed 'General case' 0 CA--C 1.582 2.193 0 CA-C-N 120.23 1.377 . . . . 0.0 111.775 -174.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -173.25 68.76 0.1 Allowed Glycine 0 N--CA 1.496 2.685 0 O-C-N 119.225 -2.172 . . . . 0.0 117.564 -175.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -108.32 27.8 8.97 Favored 'General case' 0 CA--C 1.581 2.166 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 171.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 59.0 mtmt 67.63 -43.89 0.47 Allowed 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 -174.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 70.2 m 62.41 50.35 3.75 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 116.805 2.15 . . . . 0.0 116.805 174.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 39.5 tp -76.4 -26.65 55.8 Favored 'General case' 0 CA--C 1.58 2.105 0 N-CA-C 115.186 1.551 . . . . 0.0 115.186 174.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.6 p -72.83 73.79 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.582 2.178 0 CA-C-O 123.965 1.84 . . . . 0.0 112.382 175.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 125.71 29.59 0.96 Allowed Glycine 0 CA--C 1.557 2.698 0 N-CA-C 116.723 1.449 . . . . 0.0 116.723 -174.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.2 t -151.45 144.01 24.26 Favored 'General case' 0 CA--C 1.566 1.595 0 CA-C-N 119.302 1.551 . . . . 0.0 110.661 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 5.3 tp -76.29 -64.03 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.271 0 O-C-N 121.008 -1.057 . . . . 0.0 111.193 174.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 75.8 p -89.89 166.03 13.75 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 123.39 1.567 . . . . 0.0 110.667 173.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -146.17 91.58 2.08 Favored 'General case' 0 CA--C 1.564 1.486 0 O-C-N 121.101 -0.999 . . . . 0.0 109.374 -174.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 73.5 p -99.51 -82.29 0.44 Allowed 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.64 -0.663 . . . . 0.0 109.945 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -144.28 82.59 1.7 Allowed 'General case' 0 CA--C 1.564 1.483 0 O-C-N 120.903 -1.123 . . . . 0.0 108.638 174.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -113.18 162.69 15.69 Favored 'General case' 0 CA--C 1.57 1.716 0 CA-C-O 123.094 1.426 . . . . 0.0 110.541 -178.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -139.39 -155.68 6.71 Favored Glycine 0 N--CA 1.48 1.575 0 O-C-N 120.909 -1.119 . . . . 0.0 114.555 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.9 mm -128.97 142.64 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.422 ' SG ' ' HB2' ' A' ' 49' ' ' CYS . 35.7 m -70.86 129.45 39.09 Favored 'General case' 0 CA--C 1.564 1.491 0 O-C-N 120.561 -1.337 . . . . 0.0 113.017 173.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 63.6 m-70 -140.46 155.81 46.57 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 123.203 1.478 . . . . 0.0 111.38 176.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -95.33 128.52 42.24 Favored 'General case' 0 CA--C 1.562 1.429 0 CA-C-O 122.367 1.079 . . . . 0.0 110.607 -176.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 9.9 m -103.37 40.42 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.579 2.072 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -174.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 82.13 -69.43 3.33 Favored Glycine 0 N--CA 1.493 2.434 0 O-C-N 120.274 -1.516 . . . . 0.0 116.468 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -86.92 81.35 8.15 Favored 'General case' 0 CA--C 1.572 1.804 0 CA-C-O 121.871 0.843 . . . . 0.0 111.874 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 33.1 t . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 124.804 2.24 . . . . 0.0 111.382 -179.366 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.256 8.8 p . . . . . 0 CA--C 1.585 2.321 0 CA-C-O 114.759 -2.543 . . . . 0.0 116.045 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -71.49 90.08 0.7 Allowed 'Trans proline' 0 CA--C 1.57 2.304 0 CA-C-N 127.315 3.648 . . . . 0.0 114.681 -179.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.5 t70 62.8 87.82 0.13 Allowed Pre-proline 0 CA--C 1.586 2.364 0 C-N-CA 124.78 1.232 . . . . 0.0 113.437 -174.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -53.58 -27.05 39.6 Favored 'Trans proline' 0 CA--C 1.571 2.374 0 N-CA-C 120.744 3.325 . . . . 0.0 120.744 176.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 75.23 106.89 0.08 Allowed 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 125.667 1.587 . . . . 0.0 113.47 174.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -127.16 68.89 0.53 Allowed Glycine 0 N--CA 1.494 2.539 0 O-C-N 121.556 -0.715 . . . . 0.0 113.876 173.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 48.8 mm -111.44 80.37 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -178.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.551 HD12 ' H ' ' A' ' 9' ' ' ILE 0.413 2.6 pp 50.23 -100.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.343 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 -179.345 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.551 ' H ' HD12 ' A' ' 8' ' ' ILE . 19.6 pt -115.23 177.17 2.0 Allowed 'Isoleucine or valine' 0 CA--C 1.576 1.965 0 CA-C-N 120.92 1.691 . . . . 0.0 112.623 -178.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.375 0.0 OUTLIER 80.81 80.91 0.04 OUTLIER 'General case' 0 CA--C 1.584 2.254 0 C-N-CA 126.54 1.936 . . . . 0.0 111.944 -177.758 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.86 158.97 38.74 Favored 'General case' 0 CA--C 1.573 1.858 0 CA-C-O 122.989 1.376 . . . . 0.0 111.786 173.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -80.47 165.33 22.28 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.097 -1.627 . . . . 0.0 114.456 -174.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.89 123.69 26.1 Favored 'General case' 0 CA--C 1.574 1.887 0 O-C-N 121.44 -0.787 . . . . 0.0 111.036 -179.217 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 129.0 2.37 5.62 Favored Glycine 0 CA--C 1.557 2.677 0 N-CA-C 117.371 1.708 . . . . 0.0 117.371 -173.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -121.71 155.49 35.1 Favored 'General case' 0 CA--C 1.572 1.801 0 CA-C-N 119.895 1.847 . . . . 0.0 112.0 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.4 tt -71.19 137.64 48.89 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -174.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -125.59 176.43 6.87 Favored 'General case' 0 CA--C 1.571 1.78 0 N-CA-C 115.459 1.651 . . . . 0.0 115.459 -174.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.4 mp -110.11 -75.85 0.62 Allowed 'General case' 0 CA--C 1.577 1.993 0 N-CA-C 104.463 -2.421 . . . . 0.0 104.463 169.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -96.19 -178.65 4.39 Favored 'General case' 0 CA--C 1.584 2.264 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 172.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.8 m -86.82 -19.49 28.91 Favored 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 116.617 2.081 . . . . 0.0 116.617 174.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.33 13.91 1.07 Allowed 'General case' 0 CA--C 1.578 2.051 0 N-CA-C 117.539 2.422 . . . . 0.0 117.539 174.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -95.22 -27.25 15.61 Favored 'General case' 0 CA--C 1.568 1.641 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.2 m -80.44 166.72 20.97 Favored 'General case' 0 CA--C 1.58 2.113 0 CA-C-N 120.875 1.671 . . . . 0.0 113.803 177.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.9 mtpp -67.65 -59.77 3.07 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.432 -1.417 . . . . 0.0 108.358 172.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.2 p -82.74 100.13 10.08 Favored 'General case' 0 CA--C 1.57 1.718 0 N-CA-C 102.891 -3.003 . . . . 0.0 102.891 168.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -68.5 79.72 0.27 Allowed 'General case' 0 N--CA 1.498 1.972 0 CA-C-O 125.232 2.444 . . . . 0.0 116.233 -171.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 2.1 t -146.23 95.88 2.69 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-N 111.646 -2.525 . . . . 0.0 110.188 -174.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.3 t -93.95 123.75 37.52 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 107.138 -1.431 . . . . 0.0 107.138 171.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.539 HE21 ' H ' ' A' ' 30' ' ' HIS . 29.1 tp60 -76.35 149.16 37.04 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 122.784 1.278 . . . . 0.0 110.427 174.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.539 ' H ' HE21 ' A' ' 29' ' ' GLN . 0.3 OUTLIER -61.24 155.5 20.83 Favored 'General case' 0 CA--C 1.574 1.873 1 N-CA-C 129.105 6.706 . . . . 0.0 129.105 -170.664 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -100.71 -34.34 9.89 Favored 'General case' 0 CA--C 1.578 2.024 0 CA-C-N 110.215 -3.175 . . . . 0.0 119.367 173.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.422 ' H ' ' CE1' ' A' ' 30' ' ' HIS . 0.3 OUTLIER -89.19 -55.43 3.68 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.415 -1.428 . . . . 0.0 113.79 -172.488 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 9.2 pt -76.81 -52.68 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.265 0 CA-C-N 120.48 1.491 . . . . 0.0 110.893 173.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.3 tt -95.88 118.72 33.06 Favored 'General case' 0 CA--C 1.565 1.555 0 N-CA-C 103.544 -2.762 . . . . 0.0 103.544 171.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.4 p -91.21 61.74 4.58 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 118.726 2.861 . . . . 0.0 118.726 -172.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.7 tp -173.72 110.48 0.17 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 174.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.2 m -91.11 122.05 33.42 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 121.026 1.739 . . . . 0.0 111.72 -174.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -136.48 147.38 47.13 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-N 114.31 -1.314 . . . . 0.0 111.55 -172.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 89.4 m -65.49 135.58 55.34 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 118.278 -2.764 . . . . 0.0 111.357 174.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -134.02 -176.7 4.27 Favored 'General case' 0 CA--C 1.566 1.575 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -173.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -91.51 162.02 14.72 Favored 'General case' 0 CA--C 1.573 1.857 0 CA-C-O 122.524 1.155 . . . . 0.0 113.745 177.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -81.83 153.07 26.61 Favored 'General case' 0 CA--C 1.572 1.816 0 CA-C-O 121.529 0.681 . . . . 0.0 112.354 174.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.49 158.84 28.5 Favored 'General case' 0 CA--C 1.567 1.631 0 N-CA-C 115.332 1.604 . . . . 0.0 115.332 -176.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -118.21 174.2 6.36 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 114.383 -1.28 . . . . 0.0 111.897 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -48.96 133.96 17.48 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 116.795 2.146 . . . . 0.0 116.795 -172.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.9 m120 71.57 15.47 6.06 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 -174.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.1 t -113.7 152.61 30.23 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 120.778 -1.201 . . . . 0.0 111.766 174.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -64.72 136.9 57.44 Favored 'General case' 0 CA--C 1.568 1.64 0 CA-C-O 123.313 1.53 . . . . 0.0 112.777 174.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.434 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 24.6 p -136.26 143.25 44.16 Favored 'General case' 0 CA--C 1.562 1.409 0 CA-C-N 112.911 -1.95 . . . . 0.0 112.241 -177.266 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 72.5 m -77.83 99.53 5.97 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-O 122.098 0.952 . . . . 0.0 108.787 177.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -75.74 -47.14 27.24 Favored 'General case' 0 CA--C 1.567 1.626 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 -173.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -79.17 -40.27 31.3 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 176.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.2 p 58.96 164.18 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.091 0 CA-C-O 124.332 2.015 . . . . 0.0 114.367 -174.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.74 -166.53 1.73 Allowed 'General case' 0 CA--C 1.566 1.561 0 CA-C-O 123.466 1.603 . . . . 0.0 108.916 173.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -96.16 68.37 2.66 Favored 'General case' 0 CA--C 1.576 1.96 0 N-CA-C 104.962 -2.236 . . . . 0.0 104.962 171.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 178.0 -165.75 35.45 Favored Glycine 0 N--CA 1.484 1.887 0 N-CA-C 116.474 1.35 . . . . 0.0 116.474 -173.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 2.8 t -77.89 146.62 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 CA-C-O 122.257 1.027 . . . . 0.0 111.594 -171.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -110.34 137.01 48.64 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -172.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -61.44 -52.54 64.12 Favored 'General case' 0 CA--C 1.579 2.085 0 CA-C-N 114.075 -1.42 . . . . 0.0 111.846 173.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -140.71 109.08 5.83 Favored 'General case' 0 CA--C 1.566 1.578 0 N-CA-C 104.084 -2.562 . . . . 0.0 104.084 173.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 42.8 m -48.94 156.89 0.85 Allowed Pre-proline 0 CA--C 1.587 2.393 0 N-CA-C 118.027 2.602 . . . . 0.0 118.027 -177.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -60.25 170.84 3.64 Favored 'Trans proline' 0 CA--C 1.573 2.43 0 C-N-CA 122.678 2.252 . . . . 0.0 116.179 177.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 62.5 m -73.16 149.72 42.74 Favored 'General case' 0 CA--C 1.571 1.773 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -70.48 171.98 9.21 Favored 'General case' 0 CA--C 1.577 2.003 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 -58.94 112.95 1.85 Allowed 'General case' 0 CA--C 1.576 1.967 0 O-C-N 120.551 -1.343 . . . . 0.0 113.388 -177.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 112.84 -21.9 17.55 Favored Glycine 0 N--CA 1.496 2.659 0 N-CA-C 117.751 1.86 . . . . 0.0 117.751 -173.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.7 mp -111.5 148.75 32.5 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 119.521 1.66 . . . . 0.0 111.718 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.89 153.19 23.88 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 122.22 1.01 . . . . 0.0 113.106 -177.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 7.4 t -95.21 123.95 38.98 Favored 'General case' 0 CA--C 1.569 1.678 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.529 173.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -93.72 74.54 4.3 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 119.936 -1.727 . . . . 0.0 111.404 178.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -66.83 77.1 0.15 Allowed Glycine 0 N--CA 1.495 2.581 0 N-CA-C 119.968 2.747 . . . . 0.0 119.968 -173.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -109.58 -73.63 0.68 Allowed 'General case' 0 CA--C 1.57 1.746 0 CA-C-N 114.286 -0.957 . . . . 0.0 110.879 -178.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -158.26 139.97 13.75 Favored 'General case' 0 CA--C 1.566 1.581 0 C-N-CA 124.258 1.023 . . . . 0.0 109.569 -178.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 91.6 p -107.72 -54.53 2.48 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 179.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -139.73 -102.06 0.16 Allowed 'General case' 0 N--CA 1.494 1.771 0 CA-C-N 121.598 1.999 . . . . 0.0 110.185 174.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.0 p -130.34 -10.0 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.274 0 N-CA-C 116.938 2.199 . . . . 0.0 116.938 -174.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.48 -53.32 4.36 Favored Glycine 0 N--CA 1.493 2.46 0 N-CA-C 117.529 1.772 . . . . 0.0 117.529 -178.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.4 t -54.52 -51.41 65.24 Favored 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 115.995 1.85 . . . . 0.0 115.995 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.8 pp -92.32 35.08 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 CA-C-O 122.774 1.273 . . . . 0.0 113.775 172.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.286 11.5 p 67.9 -172.4 0.19 Allowed 'General case' 0 CA--C 1.576 1.963 0 C-N-CA 126.535 1.934 . . . . 0.0 112.261 -173.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 35.4 t30 65.06 82.8 0.18 Allowed 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 107.427 -1.324 . . . . 0.0 107.427 -174.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 36.3 p -96.8 -108.96 0.16 Allowed 'General case' 0 CA--C 1.568 1.67 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.132 -169.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -105.43 61.17 0.67 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.916 -1.115 . . . . 0.0 111.578 -176.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -99.55 146.71 26.11 Favored 'General case' 0 CA--C 1.56 1.354 0 CA-C-O 122.337 1.065 . . . . 0.0 109.894 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -98.22 -178.7 32.94 Favored Glycine 0 N--CA 1.485 1.921 0 N-CA-C 115.456 0.943 . . . . 0.0 115.456 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 32.9 mm -108.9 140.9 25.75 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 171.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.434 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 57.8 m -69.7 124.47 24.05 Favored 'General case' 0 CA--C 1.566 1.561 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 174.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 78.8 m-70 -144.69 155.75 43.74 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 122.805 1.288 . . . . 0.0 112.19 175.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -96.58 139.07 33.2 Favored 'General case' 0 CA--C 1.567 1.603 0 O-C-N 121.096 -1.003 . . . . 0.0 111.208 175.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 47.3 t -122.03 78.24 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 CA-C-O 122.675 1.226 . . . . 0.0 108.447 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 177.27 58.69 0.07 OUTLIER Glycine 0 N--CA 1.49 2.256 0 N-CA-C 115.493 0.957 . . . . 0.0 115.493 178.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -83.07 73.25 10.07 Favored 'General case' 0 CA--C 1.574 1.886 0 CA-C-O 122.939 1.352 . . . . 0.0 113.917 -176.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.0 t . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 124.081 1.896 . . . . 0.0 114.077 -176.359 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 78.3 t . . . . . 0 CA--C 1.583 2.225 0 CA-C-O 115.389 -2.243 . . . . 0.0 112.145 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -58.87 -38.53 87.9 Favored 'Trans proline' 0 CA--C 1.569 2.236 0 CA-C-N 126.276 3.277 . . . . 0.0 119.111 -179.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -115.36 79.23 6.73 Favored Pre-proline 0 CA--C 1.58 2.123 0 CA-C-O 118.197 -0.906 . . . . 0.0 112.249 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -74.07 -25.92 13.43 Favored 'Trans proline' 0 CA--C 1.572 2.408 0 N-CA-C 118.794 2.575 . . . . 0.0 118.794 -178.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 68.9 ttt180 70.56 101.98 0.06 Allowed 'General case' 0 N--CA 1.498 1.964 0 C-N-CA 125.34 1.456 . . . . 0.0 113.075 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -79.86 74.63 2.26 Favored Glycine 0 N--CA 1.496 2.648 0 O-C-N 120.797 -1.19 . . . . 0.0 115.765 176.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 10.0 tt -81.38 -7.05 10.4 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.186 0 N-CA-C 118.873 2.916 . . . . 0.0 118.873 -171.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 39.9 mt 81.62 116.87 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.504 0 C-N-CA 125.545 1.538 . . . . 0.0 107.055 -174.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.1 pt -96.13 140.38 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.979 0 CA-C-O 123.249 1.5 . . . . 0.0 112.888 -173.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -153.1 43.48 0.62 Allowed 'General case' 0 CA--C 1.58 2.104 0 N-CA-C 117.01 2.226 . . . . 0.0 117.01 -174.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.8 tp -107.16 127.42 53.49 Favored 'General case' 0 CA--C 1.575 1.918 0 O-C-N 118.96 -2.337 . . . . 0.0 112.502 -175.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -81.03 172.13 14.11 Favored 'General case' 0 CA--C 1.575 1.922 0 O-C-N 119.702 -1.874 . . . . 0.0 114.522 179.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -67.37 143.7 56.2 Favored 'General case' 0 CA--C 1.569 1.674 0 C-N-CA 123.973 0.909 . . . . 0.0 112.006 176.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 98.33 -1.8 59.02 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 117.352 1.701 . . . . 0.0 117.352 -173.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -112.36 149.26 32.73 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-N 118.943 1.372 . . . . 0.0 111.701 -178.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.4 tp -70.67 130.25 41.27 Favored 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -177.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 22.0 p -132.38 150.58 52.13 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.93 0.892 . . . . 0.0 112.79 -178.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.1 tp -84.29 -78.62 0.23 Allowed 'General case' 0 CA--C 1.57 1.728 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 172.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 -94.71 170.19 9.63 Favored 'General case' 0 CA--C 1.57 1.747 0 CA-C-N 120.012 1.278 . . . . 0.0 113.684 174.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.2 p -69.62 -15.33 63.18 Favored 'General case' 0 N--CA 1.509 2.516 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 171.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.6 40.96 0.31 Allowed 'General case' 0 CA--C 1.575 1.919 0 N-CA-C 116.467 2.025 . . . . 0.0 116.467 174.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -136.15 -40.76 0.66 Allowed 'General case' 0 CA--C 1.573 1.845 0 C-N-CA 125.954 1.702 . . . . 0.0 113.08 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 74.2 m -84.64 152.22 23.95 Favored 'General case' 0 CA--C 1.567 1.605 0 N-CA-C 115.837 1.792 . . . . 0.0 115.837 -178.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -59.92 -55.88 28.65 Favored 'General case' 0 N--CA 1.503 2.209 0 C-N-CA 124.55 1.14 . . . . 0.0 109.896 173.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.6 m -82.27 102.1 10.96 Favored 'General case' 0 CA--C 1.569 1.686 0 N-CA-C 102.58 -3.119 . . . . 0.0 102.58 168.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -71.03 78.26 0.66 Allowed 'General case' 0 CA--C 1.569 1.697 0 CA-C-O 124.095 1.902 . . . . 0.0 114.583 -171.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 47.0 t -152.6 97.78 2.29 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-N 113.338 -1.756 . . . . 0.0 111.538 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 13.5 t -83.82 111.38 19.15 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 104.979 -2.23 . . . . 0.0 104.979 171.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.6 124.63 40.65 Favored 'General case' 0 CA--C 1.557 1.238 0 CA-C-O 122.472 1.129 . . . . 0.0 111.642 -172.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 -80.33 137.58 36.59 Favored 'General case' 0 CA--C 1.568 1.664 0 CA-C-O 122.698 1.237 . . . . 0.0 113.905 -174.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -63.98 -24.91 67.9 Favored 'General case' 0 CA--C 1.58 2.127 0 N-CA-C 117.5 2.407 . . . . 0.0 117.5 173.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.334 40.3 p 124.33 95.97 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 128.991 2.916 . . . . 0.0 108.496 174.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.414 7.5 tp 56.64 -49.11 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 N-CA-C 118.751 2.871 . . . . 0.0 118.751 177.669 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.6 tp -78.87 90.37 4.71 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 122.102 2.228 . . . . 0.0 108.522 173.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.3 p -52.51 103.95 0.08 Allowed 'General case' 0 CA--C 1.575 1.912 1 N-CA-C 122.514 4.265 . . . . 0.0 122.514 -171.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.0 tp -146.3 83.05 1.61 Allowed 'General case' 0 CA--C 1.572 1.799 0 N-CA-C 101.772 -3.418 . . . . 0.0 101.772 171.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.8 m -98.14 144.58 27.46 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -171.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.9 ttp180 -134.09 138.8 45.52 Favored 'General case' 0 CA--C 1.567 1.602 0 C-N-CA 124.372 1.069 . . . . 0.0 110.16 -175.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 65.1 m -68.04 144.87 54.92 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 119.694 -1.879 . . . . 0.0 114.017 177.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.75 172.81 12.18 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-N 113.416 -1.72 . . . . 0.0 114.381 -173.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 33.2 tp -81.71 143.79 31.6 Favored 'General case' 0 CA--C 1.567 1.626 0 CA-C-O 122.411 1.1 . . . . 0.0 113.196 -175.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.1 ptpt -66.2 145.53 55.68 Favored 'General case' 0 CA--C 1.574 1.874 0 CA-C-O 122.033 0.921 . . . . 0.0 113.271 174.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.13 159.75 29.53 Favored 'General case' 0 CA--C 1.569 1.682 0 N-CA-C 117.681 2.474 . . . . 0.0 117.681 -172.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.9 mtt180 -124.65 170.72 10.68 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 112.876 -1.966 . . . . 0.0 111.528 -177.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -45.34 125.87 5.93 Favored 'General case' 0 CA--C 1.571 1.78 0 N-CA-C 116.555 2.057 . . . . 0.0 116.555 -174.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 75.68 18.27 2.21 Favored 'General case' 0 N--CA 1.506 2.353 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -173.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.8 t -110.27 149.15 30.58 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 120.356 -1.465 . . . . 0.0 112.392 175.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -71.76 119.81 16.47 Favored 'General case' 0 CA--C 1.57 1.749 0 C-N-CA 124.799 1.24 . . . . 0.0 111.28 -179.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.436 ' SG ' ' HA ' ' A' ' 62' ' ' PRO . 0.6 OUTLIER -123.87 154.35 39.78 Favored 'General case' 0 CA--C 1.564 1.499 0 CA-C-O 123.305 1.526 . . . . 0.0 114.427 -174.621 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.3 t -93.65 109.55 21.18 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 171.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.0 10.13 3.11 Favored 'General case' 0 CA--C 1.582 2.203 0 N-CA-C 118.325 2.713 . . . . 0.0 118.325 -179.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 44.4 p90 -143.69 160.44 40.7 Favored 'General case' 0 CA--C 1.57 1.718 0 C-N-CA 126.47 1.908 . . . . 0.0 111.076 -173.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.7 p -131.2 136.52 48.34 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 122.675 1.226 . . . . 0.0 109.637 172.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -99.78 -136.74 0.3 Allowed 'General case' 0 CA--C 1.566 1.577 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 173.305 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -128.18 74.12 1.52 Allowed 'General case' 0 CA--C 1.568 1.667 0 N-CA-C 103.414 -2.81 . . . . 0.0 103.414 170.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 161.33 -146.2 11.94 Favored Glycine 0 N--CA 1.488 2.11 0 N-CA-C 117.294 1.678 . . . . 0.0 117.294 -175.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.0 t -91.35 147.18 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 CA-C-O 122.92 1.343 . . . . 0.0 112.52 -166.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -119.86 137.13 54.19 Favored 'General case' 0 CA--C 1.556 1.208 0 CA-C-O 122.349 1.071 . . . . 0.0 110.787 -174.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -76.08 -9.74 58.86 Favored 'General case' 0 CA--C 1.582 2.196 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 174.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 11.3 ptpt -163.91 125.01 2.26 Favored 'General case' 0 CA--C 1.567 1.608 0 N-CA-C 105.965 -1.865 . . . . 0.0 105.965 175.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 64.0 m -62.67 144.01 96.34 Favored Pre-proline 0 CA--C 1.589 2.474 0 N-CA-C 117.123 2.268 . . . . 0.0 117.123 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.436 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 77.5 Cg_exo -56.93 170.44 1.45 Allowed 'Trans proline' 0 CA--C 1.575 2.552 0 C-N-CA 123.067 2.511 . . . . 0.0 117.148 174.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 60.3 m -77.18 163.68 26.34 Favored 'General case' 0 CA--C 1.578 2.045 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -74.63 173.03 11.01 Favored 'General case' 0 CA--C 1.578 2.036 0 N-CA-C 117.351 2.352 . . . . 0.0 117.351 -175.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 53.1 tpt85 -66.94 113.47 4.99 Favored 'General case' 0 CA--C 1.571 1.756 0 O-C-N 120.524 -1.36 . . . . 0.0 111.6 174.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.63 -0.3 59.51 Favored Glycine 0 N--CA 1.499 2.841 0 N-CA-C 118.262 2.065 . . . . 0.0 118.262 -173.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.9 tt -135.79 132.81 37.2 Favored 'General case' 0 CA--C 1.568 1.671 0 CA-C-N 119.401 1.6 . . . . 0.0 107.742 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.32 159.85 14.73 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 116.445 2.017 . . . . 0.0 116.445 -171.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.9 t -93.11 127.62 38.72 Favored 'General case' 0 CA--C 1.57 1.747 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.653 173.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -97.96 78.64 2.56 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 119.813 -1.804 . . . . 0.0 110.329 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -70.44 71.56 0.64 Allowed Glycine 0 N--CA 1.496 2.675 0 N-CA-C 118.999 2.359 . . . . 0.0 118.999 -174.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -112.47 -67.79 0.97 Allowed 'General case' 0 CA--C 1.57 1.731 0 C-N-CA 123.853 0.861 . . . . 0.0 110.364 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt -163.25 136.24 5.54 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 124.088 0.955 . . . . 0.0 109.286 174.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.6 t -141.61 96.01 2.91 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.672 -1.267 . . . . 0.0 109.816 178.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 30.0 tp 66.31 101.59 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 125.392 1.477 . . . . 0.0 113.503 177.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 86.0 t -63.32 -40.49 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.352 0 N-CA-C 114.73 1.382 . . . . 0.0 114.73 -178.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -87.45 26.24 7.36 Favored Glycine 0 N--CA 1.495 2.571 0 N-CA-C 119.864 2.706 . . . . 0.0 119.864 175.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 87.9 p -87.27 57.78 4.64 Favored 'General case' 0 N--CA 1.497 1.906 0 CA-C-N 120.675 2.238 . . . . 0.0 113.331 174.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.376 13.7 pt 59.53 -61.71 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.514 2.758 0 C-N-CA 126.543 1.937 . . . . 0.0 114.316 -173.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 38.9 p -118.46 156.82 28.37 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 122.849 1.309 . . . . 0.0 109.785 173.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -147.36 90.66 1.89 Allowed 'General case' 0 CA--C 1.562 1.412 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . 0.276 2.5 t -104.08 -95.69 0.32 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 123.613 0.765 . . . . 0.0 109.025 -177.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -126.34 71.22 1.26 Allowed 'General case' 0 N--CA 1.493 1.713 0 CA-C-N 120.531 1.514 . . . . 0.0 109.805 174.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -98.69 150.86 21.35 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 122.741 1.258 . . . . 0.0 110.392 177.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -142.02 -171.21 12.9 Favored Glycine 0 N--CA 1.48 1.58 0 CA-C-N 115.351 -0.841 . . . . 0.0 115.194 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 32.3 mm -114.4 137.24 48.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 174.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 64.5 m -67.87 125.95 27.9 Favored 'General case' 0 CA--C 1.568 1.637 0 O-C-N 120.903 -1.123 . . . . 0.0 113.349 174.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -143.22 156.97 44.87 Favored 'General case' 0 CA--C 1.561 1.394 0 CA-C-O 123.43 1.585 . . . . 0.0 111.662 175.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -98.23 108.55 21.28 Favored 'General case' 0 CA--C 1.563 1.478 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 174.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.6 p -95.69 68.44 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 CA-C-O 123.579 1.656 . . . . 0.0 111.81 -174.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.02 54.91 4.61 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 117.677 1.831 . . . . 0.0 117.677 -177.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . 0.323 4.9 ptm180 45.02 -106.54 0.11 Allowed 'General case' 0 CA--C 1.579 2.077 0 N-CA-C 116.248 1.944 . . . . 0.0 116.248 -179.286 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 10.3 t . . . . . 0 N--CA 1.498 1.952 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 176.36 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 74.7 t . . . . . 0 CA--C 1.581 2.161 0 CA-C-O 115.914 -1.993 . . . . 0.0 110.967 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -64.23 -35.25 52.9 Favored 'Trans proline' 0 CA--C 1.568 2.213 0 CA-C-N 125.828 3.117 . . . . 0.0 118.452 -175.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 50.62 71.74 1.45 Allowed Pre-proline 0 CA--C 1.589 2.476 0 N-CA-C 115.945 1.831 . . . . 0.0 115.945 174.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -81.7 75.76 4.68 Favored 'Trans proline' 0 CA--C 1.572 2.391 0 C-N-CA 122.247 1.965 . . . . 0.0 115.932 -174.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -135.85 81.19 1.87 Allowed 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.913 0.864 . . . . 0.0 108.736 175.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 160.21 109.58 0.25 Allowed Glycine 0 N--CA 1.486 2.023 0 O-C-N 121.21 -0.931 . . . . 0.0 112.119 -174.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 41.9 mm -85.93 -76.87 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 CA-C-O 119.191 -0.433 . . . . 0.0 110.1 -176.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.431 HG23 ' H ' ' A' ' 9' ' ' ILE 0.314 9.8 tp -151.02 -115.95 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 174.854 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.431 ' H ' HG23 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -99.43 -149.2 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.583 2.233 0 CA-C-N 121.075 1.761 . . . . 0.0 110.484 174.668 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 -146.57 111.21 5.22 Favored 'General case' 0 CA--C 1.573 1.848 0 O-C-N 119.031 -2.293 . . . . 0.0 113.602 -174.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 17.8 tp -96.68 96.68 8.79 Favored 'General case' 0 CA--C 1.568 1.636 0 O-C-N 120.15 -1.594 . . . . 0.0 113.442 174.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -98.24 151.68 20.21 Favored 'General case' 0 CA--C 1.578 2.026 0 N-CA-C 106.101 -1.814 . . . . 0.0 106.101 166.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -81.21 102.6 10.44 Favored 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 104.125 -2.546 . . . . 0.0 104.125 171.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 128.57 26.87 0.92 Allowed Glycine 0 CA--C 1.546 2.004 0 CA-C-N 113.547 -1.661 . . . . 0.0 115.669 -172.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -93.35 105.62 17.67 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 119.886 1.843 . . . . 0.0 108.167 172.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 mp -72.56 104.54 3.89 Favored 'General case' 0 N--CA 1.493 1.725 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 175.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 2.5 p -111.47 173.05 6.53 Favored 'General case' 0 CA--C 1.563 1.447 0 N-CA-C 117.888 2.551 . . . . 0.0 117.888 -171.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.1 tp -94.46 -73.71 0.57 Allowed 'General case' 0 CA--C 1.579 2.058 0 N-CA-C 105.965 -1.865 . . . . 0.0 105.965 170.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -100.7 -165.0 1.16 Allowed 'General case' 0 CA--C 1.583 2.249 0 C-N-CA 125.217 1.407 . . . . 0.0 113.707 172.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.1 m -93.61 -0.24 56.25 Favored 'General case' 0 N--CA 1.504 2.237 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 173.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.18 11.16 1.98 Allowed 'General case' 0 CA--C 1.578 2.037 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 174.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -96.2 -33.39 12.04 Favored 'General case' 0 CA--C 1.587 2.389 0 C-N-CA 125.766 1.627 . . . . 0.0 111.598 172.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . 0.305 85.0 m -87.6 131.33 34.45 Favored 'General case' 0 CA--C 1.587 2.388 0 C-N-CA 125.477 1.511 . . . . 0.0 109.674 172.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -41.33 -50.99 3.74 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 121.676 3.954 . . . . 0.0 121.676 -171.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 100.0 p -80.09 -77.33 0.19 Allowed 'General case' 0 CA--C 1.569 1.682 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 174.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -178.11 78.36 0.02 OUTLIER 'General case' 0 CA--C 1.571 1.752 0 N-CA-C 104.147 -2.538 . . . . 0.0 104.147 172.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 40.6 t -142.1 59.8 1.47 Allowed 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 116.203 1.927 . . . . 0.0 116.203 -173.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.525 ' HA ' ' SG ' ' A' ' 39' ' ' CYS . 19.3 t -92.84 119.53 32.27 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 169.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.91 115.73 31.1 Favored 'General case' 0 CA--C 1.569 1.703 0 CA-C-O 123.415 1.579 . . . . 0.0 113.745 -171.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.597 ' HB2' HG12 ' A' ' 57' ' ' VAL . 0.3 OUTLIER -87.91 118.04 27.18 Favored 'General case' 0 CA--C 1.565 1.55 0 C-N-CA 124.775 1.23 . . . . 0.0 111.201 -178.448 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -83.76 44.2 0.97 Allowed 'General case' 0 CA--C 1.584 2.255 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 176.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.412 0.7 OUTLIER 106.54 176.65 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.699 0 C-N-CA 128.842 2.857 . . . . 0.0 112.167 -174.808 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 28.1 mm -54.07 -67.54 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.527 0 O-C-N 119.532 -1.98 . . . . 0.0 115.296 -173.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 pp -97.68 49.97 1.04 Allowed 'General case' 0 N--CA 1.509 2.486 0 CA-C-N 120.517 1.508 . . . . 0.0 113.451 176.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.2 p -102.33 -3.52 27.02 Favored 'General case' 0 N--CA 1.492 1.663 1 N-CA-C 121.906 4.039 . . . . 0.0 121.906 -172.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 21.7 tp 70.6 120.16 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.174 0 CA-C-N 120.288 1.403 . . . . 0.0 109.566 -173.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.615 ' HB3' HG11 ' A' ' 57' ' ' VAL . 50.7 m -94.78 124.63 38.93 Favored 'General case' 0 CA--C 1.561 1.386 0 O-C-N 120.377 -1.452 . . . . 0.0 114.741 -172.322 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.3 ttt85 -132.1 134.21 45.2 Favored 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 124.43 1.092 . . . . 0.0 110.283 -175.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.525 ' SG ' ' HA ' ' A' ' 28' ' ' CYS . 89.3 m -70.35 151.04 45.68 Favored 'General case' 0 CA--C 1.56 1.355 0 O-C-N 119.511 -1.993 . . . . 0.0 114.224 177.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.29 -174.21 3.88 Favored 'General case' 0 CA--C 1.565 1.531 0 CA-C-N 113.031 -1.895 . . . . 0.0 113.374 -173.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.5 mt -79.58 149.4 31.39 Favored 'General case' 0 CA--C 1.57 1.737 0 CA-C-O 122.225 1.012 . . . . 0.0 112.191 175.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -69.35 153.25 43.89 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 175.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.07 151.51 40.15 Favored 'General case' 0 CA--C 1.57 1.743 0 CA-C-O 124.242 1.972 . . . . 0.0 113.941 -174.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -118.99 168.41 10.83 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-N 113.427 -1.715 . . . . 0.0 110.968 -175.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -53.1 120.9 6.47 Favored 'General case' 0 CA--C 1.571 1.774 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -173.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 79.48 25.53 0.42 Allowed 'General case' 0 N--CA 1.505 2.317 0 C-N-CA 125.439 1.496 . . . . 0.0 113.789 -172.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.7 t -126.61 154.1 44.42 Favored 'General case' 0 CA--C 1.567 1.618 0 O-C-N 120.378 -1.451 . . . . 0.0 110.492 174.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -64.59 130.84 45.19 Favored 'General case' 0 CA--C 1.574 1.883 0 N-CA-C 116.764 2.135 . . . . 0.0 116.764 -173.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.55 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 24.5 p -141.04 141.99 34.25 Favored 'General case' 0 CA--C 1.563 1.47 0 CA-C-N 113.112 -1.858 . . . . 0.0 113.099 177.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.5 t -87.01 134.39 33.49 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 170.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.43 -26.16 62.63 Favored 'General case' 0 CA--C 1.578 2.027 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 -177.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -127.46 157.37 40.24 Favored 'General case' 0 CA--C 1.572 1.801 0 C-N-CA 125.448 1.499 . . . . 0.0 107.897 172.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 17.6 p -129.24 160.46 32.88 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 124.146 1.927 . . . . 0.0 110.308 172.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.288 0.7 OUTLIER -96.49 -121.99 0.12 Allowed 'General case' 0 CA--C 1.575 1.917 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 174.347 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.37 3.15 2.56 Favored 'General case' 0 CA--C 1.589 2.452 0 O-C-N 119.62 -1.925 . . . . 0.0 112.622 171.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -99.85 -162.12 28.83 Favored Glycine 0 N--CA 1.481 1.675 0 O-C-N 120.557 -1.339 . . . . 0.0 113.403 -175.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.615 HG11 ' HB3' ' A' ' 37' ' ' SER . 4.9 t -79.41 137.42 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 CA-C-O 123.093 1.425 . . . . 0.0 109.86 -175.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -111.58 140.25 46.35 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -171.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -71.99 -1.73 15.62 Favored 'General case' 0 CA--C 1.587 2.389 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 174.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.3 123.62 0.97 Allowed 'General case' 0 CA--C 1.574 1.883 0 C-N-CA 127.879 2.472 . . . . 0.0 107.104 -174.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 36.2 m -70.73 129.07 90.27 Favored Pre-proline 0 CA--C 1.594 2.661 0 O-C-N 118.973 -2.33 . . . . 0.0 111.032 173.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -76.41 76.5 3.91 Favored 'Trans proline' 0 CA--C 1.573 2.427 0 N-CA-C 119.236 2.745 . . . . 0.0 119.236 -172.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 58.5 m 60.4 145.39 0.01 OUTLIER 'General case' 0 CA--C 1.578 2.041 0 N-CA-C 116.998 2.222 . . . . 0.0 116.998 174.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -65.78 162.01 19.65 Favored 'General case' 0 CA--C 1.578 2.038 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 174.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -63.02 109.28 1.43 Allowed 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.768 -1.207 . . . . 0.0 112.503 -177.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 112.92 -23.39 14.57 Favored Glycine 0 N--CA 1.498 2.812 0 N-CA-C 117.606 1.802 . . . . 0.0 117.606 -173.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.3 tp -99.1 143.22 29.62 Favored 'General case' 0 CA--C 1.572 1.79 0 CA-C-N 118.509 1.154 . . . . 0.0 111.625 -178.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -98.54 159.11 15.17 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.472 -1.393 . . . . 0.0 114.087 -174.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 10.4 t -93.8 123.7 37.31 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.687 172.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -96.2 121.8 38.36 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.711 -1.243 . . . . 0.0 108.782 176.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -70.58 64.49 0.83 Allowed Glycine 0 N--CA 1.497 2.72 0 N-CA-C 119.702 2.641 . . . . 0.0 119.702 -174.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -84.94 79.54 9.6 Favored 'General case' 0 CA--C 1.571 1.773 0 C-N-CA 124.085 0.954 . . . . 0.0 110.679 177.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt 67.19 163.23 0.19 Allowed 'General case' 0 N--CA 1.502 2.147 0 CA-C-O 123.117 1.437 . . . . 0.0 114.635 -176.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 28.7 m -156.31 -78.29 0.09 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.181 -1.574 . . . . 0.0 109.404 174.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -89.8 65.97 6.91 Favored 'General case' 0 CA--C 1.576 1.958 0 O-C-N 120.403 -1.436 . . . . 0.0 112.55 -177.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.5 p -92.0 -15.28 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.294 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 -178.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -148.99 -71.61 0.01 OUTLIER Glycine 0 N--CA 1.493 2.464 0 O-C-N 120.592 -1.318 . . . . 0.0 114.603 178.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 61.1 m -91.89 157.76 16.67 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 121.818 0.818 . . . . 0.0 112.849 174.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.5 pp -79.72 98.13 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.157 0 N-CA-C 104.825 -2.287 . . . . 0.0 104.825 173.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.275 16.7 p 69.58 163.26 0.24 Allowed 'General case' 0 CA--C 1.579 2.091 0 C-N-CA 125.261 1.424 . . . . 0.0 111.085 -170.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.1 t30 56.78 63.8 1.84 Allowed 'General case' 0 N--CA 1.514 2.742 0 O-C-N 119.791 -1.818 . . . . 0.0 108.71 -172.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . 0.313 1.6 t -136.23 -111.86 0.19 Allowed 'General case' 0 CA--C 1.568 1.672 0 C-N-CA 123.757 0.823 . . . . 0.0 110.484 -168.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -150.42 113.26 4.77 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 178.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -109.32 176.62 5.02 Favored 'General case' 0 CA--C 1.571 1.786 0 CA-C-O 122.027 0.918 . . . . 0.0 112.883 -172.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.65 -179.2 3.23 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 118.518 2.167 . . . . 0.0 118.518 178.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 39.3 mm -126.32 139.2 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.283 -1.128 . . . . 0.0 110.461 -174.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.55 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 59.7 m -69.11 128.35 36.33 Favored 'General case' 0 CA--C 1.57 1.717 0 O-C-N 120.291 -1.506 . . . . 0.0 114.464 174.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -141.7 158.99 43.13 Favored 'General case' 0 CA--C 1.565 1.547 0 CA-C-O 123.309 1.528 . . . . 0.0 111.922 175.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -97.65 128.14 44.13 Favored 'General case' 0 CA--C 1.562 1.433 0 CA-C-O 122.669 1.223 . . . . 0.0 111.385 178.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 12.3 p -146.42 74.41 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 CA-C-O 123.044 1.402 . . . . 0.0 109.093 177.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 157.16 -57.07 0.38 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 117.039 1.575 . . . . 0.0 117.039 -175.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 -76.14 -76.5 0.16 Allowed 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 118.54 1.17 . . . . 0.0 113.681 -172.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 95.9 p . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 124.294 1.997 . . . . 0.0 112.188 -179.766 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 8.9 p . . . . . 0 CA--C 1.587 2.379 0 CA-C-O 114.337 -2.744 . . . . 0.0 116.67 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -63.86 89.56 0.15 Allowed 'Trans proline' 0 CA--C 1.573 2.442 0 CA-C-N 127.344 3.658 . . . . 0.0 116.51 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -146.97 129.34 7.71 Favored Pre-proline 0 CA--C 1.58 2.106 0 CA-C-O 117.696 -1.145 . . . . 0.0 109.199 -175.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -75.67 77.82 3.24 Favored 'Trans proline' 0 CA--C 1.573 2.442 0 C-N-CA 122.753 2.302 . . . . 0.0 116.124 -174.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 72.5 mtm180 -100.87 -1.56 34.37 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 -177.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 89.45 -69.95 2.47 Favored Glycine 0 N--CA 1.494 2.522 0 CA-C-N 121.082 1.764 . . . . 0.0 115.617 -179.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 62.2 mt -91.61 82.08 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 176.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 63.0 mt -103.67 101.04 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.461 HG12 ' H ' ' A' ' 10' ' ' ASN . 0.1 OUTLIER -97.95 -69.12 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -175.166 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.461 ' H ' HG12 ' A' ' 9' ' ' ILE 0.3 0.5 OUTLIER 53.48 76.26 0.22 Allowed 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 116.952 2.204 . . . . 0.0 116.952 177.937 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.5 tp -129.77 126.21 37.62 Favored 'General case' 0 CA--C 1.574 1.895 0 C-N-CA 124.49 1.116 . . . . 0.0 108.934 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -80.31 167.34 20.38 Favored 'General case' 0 CA--C 1.573 1.862 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -174.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -63.72 138.15 58.37 Favored 'General case' 0 CA--C 1.572 1.815 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -176.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.81 -11.33 38.25 Favored Glycine 0 N--CA 1.496 2.653 0 N-CA-C 118.391 2.116 . . . . 0.0 118.391 -175.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 82.3 mm-40 -100.21 137.42 38.67 Favored 'General case' 0 CA--C 1.564 1.506 0 CA-C-N 118.99 1.395 . . . . 0.0 111.081 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 77.7 mt -67.45 134.3 51.14 Favored 'General case' 0 CA--C 1.573 1.853 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -174.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.5 p -122.97 177.84 5.32 Favored 'General case' 0 CA--C 1.573 1.849 0 CA-C-O 123.029 1.395 . . . . 0.0 113.408 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.9 mt -109.45 -74.41 0.66 Allowed 'General case' 0 CA--C 1.574 1.889 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 171.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.1 p30 -91.39 -173.23 3.53 Favored 'General case' 0 CA--C 1.581 2.154 0 C-N-CA 124.607 1.163 . . . . 0.0 113.181 172.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.8 t -94.4 -4.94 47.49 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 116.921 2.193 . . . . 0.0 116.921 174.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.44 1.87 15.24 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 117.382 2.364 . . . . 0.0 117.382 174.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -95.27 -20.92 18.78 Favored 'General case' 0 CA--C 1.57 1.717 0 N-CA-C 115.966 1.839 . . . . 0.0 115.966 -175.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.0 m -81.44 -131.72 0.03 OUTLIER 'General case' 0 CA--C 1.579 2.074 0 CA-C-N 121.236 1.834 . . . . 0.0 114.124 -175.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -72.73 -82.8 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.354 0 O-C-N 119.423 -2.048 . . . . 0.0 111.328 -177.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.6 p -88.79 -63.07 1.35 Allowed 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 121.966 0.889 . . . . 0.0 110.744 172.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -170.05 84.81 0.12 Allowed 'General case' 0 CA--C 1.569 1.706 0 N-CA-C 105.159 -2.163 . . . . 0.0 105.159 178.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.414 ' SG ' ' HB3' ' A' ' 40' ' ' ALA . 41.9 t -155.32 94.44 1.61 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 119.825 -1.797 . . . . 0.0 115.118 -176.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.513 ' HB3' HG13 ' A' ' 57' ' ' VAL . 9.8 t -114.81 139.39 49.77 Favored 'General case' 0 CA--C 1.56 1.364 0 CA-C-O 121.759 0.79 . . . . 0.0 108.988 171.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.46 124.61 29.06 Favored 'General case' 0 CA--C 1.573 1.837 0 CA-C-O 122.106 0.955 . . . . 0.0 109.124 174.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.71 ' HA ' ' CG1' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -27.45 4.93 0.0 OUTLIER 'General case' 0 CA--C 1.592 2.586 3 N-CA-C 142.845 11.794 . . . . 0.0 142.845 -166.852 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . 0.261 1.3 p30 -24.65 72.49 0.0 OUTLIER 'General case' 0 N--CA 1.531 3.592 2 CA-C-N 131.633 6.56 . . . . 0.0 125.005 -167.732 . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.4 t -139.85 14.74 2.49 Favored 'General case' 0 CA--C 1.583 2.235 0 CA-C-N 114.05 -1.432 . . . . 0.0 113.957 173.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.0 pt -140.12 -59.04 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 CA-C-N 120.054 1.297 . . . . 0.0 111.535 174.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 93.8 mt -131.86 -68.22 0.65 Allowed 'General case' 0 N--CA 1.498 1.936 0 CA-C-N 120.513 1.506 . . . . 0.0 113.171 -174.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.7 p -90.01 163.95 14.71 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 -174.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.6 tp -66.98 163.02 20.71 Favored 'General case' 0 CA--C 1.584 2.282 0 O-C-N 121.517 -0.739 . . . . 0.0 111.9 173.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.1 m -91.96 127.62 37.5 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 119.885 -1.759 . . . . 0.0 111.732 -172.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -111.66 154.51 24.82 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.86 174.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 55.7 m -63.57 151.5 41.35 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 118.751 -2.468 . . . . 0.0 112.099 174.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.414 ' HB3' ' SG ' ' A' ' 27' ' ' CYS 0.275 . . -133.82 -172.64 3.03 Favored 'General case' 0 CA--C 1.567 1.612 0 CA-C-N 113.123 -1.853 . . . . 0.0 110.663 -175.88 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 94.4 mt -125.0 150.42 46.72 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.856 -1.152 . . . . 0.0 112.008 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -63.9 144.03 57.39 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.383 -0.823 . . . . 0.0 111.456 173.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.96 147.03 35.13 Favored 'General case' 0 CA--C 1.566 1.586 0 CA-C-O 124.678 2.18 . . . . 0.0 116.246 -173.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -101.56 170.27 8.3 Favored 'General case' 0 CA--C 1.56 1.336 0 CA-C-N 111.449 -2.614 . . . . 0.0 111.161 -178.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -59.26 124.26 19.4 Favored 'General case' 0 CA--C 1.57 1.741 0 O-C-N 120.84 -1.162 . . . . 0.0 112.851 -175.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 83.21 22.01 0.17 Allowed 'General case' 0 N--CA 1.506 2.359 0 C-N-CA 125.602 1.561 . . . . 0.0 113.859 -172.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.4 t -121.28 150.1 41.91 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.059 -1.651 . . . . 0.0 111.657 174.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -69.08 141.7 54.66 Favored 'General case' 0 CA--C 1.57 1.713 0 CA-C-O 123.305 1.526 . . . . 0.0 113.391 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 8.5 p -140.33 148.81 41.91 Favored 'General case' 0 CA--C 1.564 1.514 0 CA-C-N 113.127 -1.851 . . . . 0.0 113.387 -175.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.5 p -77.26 110.51 12.03 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 120.878 -1.138 . . . . 0.0 108.421 173.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -76.3 20.23 0.22 Allowed 'General case' 0 CA--C 1.576 1.963 0 N-CA-C 120.46 3.504 . . . . 0.0 120.46 -172.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -158.1 -56.47 0.07 Allowed 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 124.869 1.268 . . . . 0.0 113.348 -174.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.8 p 72.29 147.12 0.08 Allowed 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 127.607 2.363 . . . . 0.0 113.702 -174.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -100.06 -139.24 0.32 Allowed 'General case' 0 CA--C 1.576 1.956 0 CA-C-N 113.143 -1.844 . . . . 0.0 107.04 172.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -136.78 68.82 1.42 Allowed 'General case' 0 CA--C 1.567 1.625 0 CA-C-O 123.796 1.76 . . . . 0.0 107.921 169.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -177.66 -156.96 17.52 Favored Glycine 0 CA--C 1.544 1.858 0 CA-C-N 113.781 -1.554 . . . . 0.0 111.522 -176.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.71 ' CG1' ' HA ' ' A' ' 30' ' ' HIS . 1.2 t -75.17 154.47 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.213 0 O-C-N 121.283 -1.127 . . . . 0.0 112.928 -171.003 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -123.11 139.1 54.41 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 116.581 2.067 . . . . 0.0 116.581 -171.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -68.71 -38.88 80.59 Favored 'General case' 0 N--CA 1.502 2.128 0 N-CA-C 113.853 1.056 . . . . 0.0 113.853 172.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -143.01 109.14 5.24 Favored 'General case' 0 CA--C 1.563 1.479 0 N-CA-C 104.381 -2.451 . . . . 0.0 104.381 174.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 49.2 m -52.23 150.81 7.88 Favored Pre-proline 0 CA--C 1.588 2.415 0 N-CA-C 116.085 1.883 . . . . 0.0 116.085 178.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -63.25 166.28 15.21 Favored 'Trans proline' 0 CA--C 1.572 2.385 0 C-N-CA 122.308 2.005 . . . . 0.0 115.924 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 80.3 m -69.2 150.73 47.16 Favored 'General case' 0 CA--C 1.572 1.805 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 178.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -71.24 163.47 27.58 Favored 'General case' 0 CA--C 1.573 1.857 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 174.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -54.55 118.55 4.26 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 -174.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.04 -29.49 9.66 Favored Glycine 0 CA--C 1.556 2.648 0 CA-C-N 114.153 -1.385 . . . . 0.0 115.851 -172.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.9 mp -99.57 144.11 29.05 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-O 122.77 1.271 . . . . 0.0 112.115 -177.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -112.16 159.14 18.84 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 124.16 0.984 . . . . 0.0 112.607 -177.079 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 3.0 t -88.83 80.79 7.08 Favored 'General case' 0 CA--C 1.575 1.926 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 177.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -100.14 103.41 14.9 Favored 'General case' 0 CA--C 1.569 1.675 0 O-C-N 120.932 -1.105 . . . . 0.0 113.307 -174.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 174.36 -103.98 0.19 Allowed Glycine 0 N--CA 1.49 2.288 0 O-C-N 120.519 -1.363 . . . . 0.0 113.726 174.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -94.24 132.42 38.83 Favored 'General case' 0 CA--C 1.57 1.731 0 CA-C-O 122.535 1.16 . . . . 0.0 111.098 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -75.12 113.13 12.11 Favored 'General case' 0 CA--C 1.567 1.629 0 O-C-N 121.383 -0.823 . . . . 0.0 113.104 -174.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 50.9 m -73.07 -10.64 60.0 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 119.693 3.219 . . . . 0.0 119.693 -174.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.6 mp -81.53 71.88 8.55 Favored 'General case' 0 CA--C 1.575 1.924 0 CA-C-N 121.098 1.772 . . . . 0.0 111.783 178.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 79.0 t -120.83 -60.5 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 C-N-CA 123.789 0.836 . . . . 0.0 110.18 -177.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -136.15 54.02 0.74 Allowed Glycine 0 N--CA 1.494 2.565 0 N-CA-C 116.652 1.421 . . . . 0.0 116.652 177.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 70.5 m 49.56 -106.54 0.21 Allowed 'General case' 0 N--CA 1.503 2.177 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 176.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.4 pp -98.01 63.0 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 CA-C-O 123.776 1.75 . . . . 0.0 113.444 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 17.3 p -130.04 154.56 47.3 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 122.903 1.335 . . . . 0.0 112.208 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -83.47 73.04 10.23 Favored 'General case' 0 CA--C 1.574 1.889 0 CA-C-O 122.36 1.076 . . . . 0.0 110.069 174.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.6 t -106.56 -67.18 0.95 Allowed 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 115.226 1.565 . . . . 0.0 115.226 -172.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 -143.17 128.3 18.63 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.108 0.963 . . . . 0.0 109.545 -174.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -136.77 144.46 43.78 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-O 122.495 1.14 . . . . 0.0 111.977 178.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -78.74 163.92 50.1 Favored Glycine 0 N--CA 1.489 2.205 0 CA-C-N 115.762 -0.654 . . . . 0.0 114.595 178.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 35.2 mm -103.63 132.57 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 69.6 m -62.14 119.75 9.56 Favored 'General case' 0 CA--C 1.564 1.502 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 176.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -143.99 154.1 42.93 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-O 122.324 1.059 . . . . 0.0 110.82 175.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -92.89 87.51 5.83 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 123.761 1.744 . . . . 0.0 110.374 -174.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.4 t -127.22 87.58 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 CA-C-N 113.165 -1.834 . . . . 0.0 107.001 -174.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -50.42 -39.88 37.47 Favored Glycine 0 N--CA 1.5 2.963 0 N-CA-C 119.932 2.733 . . . . 0.0 119.932 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 56.5 ttp180 -81.81 84.88 6.74 Favored 'General case' 0 CA--C 1.574 1.894 0 CA-C-N 118.381 1.09 . . . . 0.0 110.542 169.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.501 2.079 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 -179.159 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 15.1 m . . . . . 0 CA--C 1.579 2.063 0 CA-C-O 118.721 -0.657 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -55.26 -33.06 83.43 Favored 'Trans proline' 0 CA--C 1.573 2.435 0 N-CA-C 118.523 2.47 . . . . 0.0 118.523 174.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 p30 -104.2 107.37 57.13 Favored Pre-proline 0 CA--C 1.578 2.056 0 CA-C-O 117.331 -1.319 . . . . 0.0 109.813 174.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -56.85 -42.74 61.38 Favored 'Trans proline' 0 CA--C 1.569 2.238 0 N-CA-C 119.079 2.684 . . . . 0.0 119.079 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 71.6 -54.02 0.68 Allowed 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -80.92 56.28 4.8 Favored Glycine 0 N--CA 1.496 2.68 0 N-CA-C 118.654 2.222 . . . . 0.0 118.654 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 50.7 mm -124.01 -74.94 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 176.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.8 tp -154.59 134.11 3.67 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.798 0 O-C-N 120.977 -1.077 . . . . 0.0 109.43 176.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.6 pt -97.46 -123.75 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.586 2.342 0 O-C-N 121.397 -0.814 . . . . 0.0 109.718 174.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 71.7 m-80 58.15 74.78 0.41 Allowed 'General case' 0 CA--C 1.582 2.205 0 N-CA-C 118.015 2.598 . . . . 0.0 118.015 177.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 48.6 tp -103.27 142.82 33.54 Favored 'General case' 0 CA--C 1.58 2.107 0 O-C-N 119.734 -1.854 . . . . 0.0 109.178 173.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.86 179.68 7.7 Favored 'General case' 0 CA--C 1.572 1.798 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -174.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -74.4 168.47 19.63 Favored 'General case' 0 CA--C 1.575 1.916 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.97 13.63 74.28 Favored Glycine 0 CA--C 1.561 2.929 0 N-CA-C 117.13 1.612 . . . . 0.0 117.13 -172.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -117.91 143.27 46.48 Favored 'General case' 0 CA--C 1.567 1.609 0 C-N-CA 125.21 1.404 . . . . 0.0 110.504 -173.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.3 tt -71.94 131.11 42.5 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.872 -1.143 . . . . 0.0 111.271 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.54 ' SG ' ' O ' ' A' ' 19' ' ' ASN . 0.4 OUTLIER -135.96 154.25 51.16 Favored 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -173.751 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.5 mt -100.72 -67.56 0.85 Allowed 'General case' 0 CA--C 1.576 1.969 0 CA-C-N 113.622 -1.626 . . . . 0.0 108.983 171.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.54 ' O ' ' SG ' ' A' ' 17' ' ' CYS . 62.1 m-20 -108.18 -171.58 1.89 Allowed 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 120.776 1.625 . . . . 0.0 114.894 173.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.7 m -64.61 -30.69 71.71 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 118.92 -2.363 . . . . 0.0 113.769 172.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.31 43.34 1.01 Allowed 'General case' 0 CA--C 1.576 1.947 0 N-CA-C 116.112 1.893 . . . . 0.0 116.112 173.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -117.7 -71.12 0.75 Allowed 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 102.281 -3.229 . . . . 0.0 102.281 171.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 34.7 m -84.89 81.04 9.06 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 103.437 -2.801 . . . . 0.0 103.437 167.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.7 mttm -66.76 5.92 0.56 Allowed 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 120.164 3.394 . . . . 0.0 120.164 -169.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.6 p -73.22 -72.93 0.23 Allowed 'General case' 0 CA--C 1.572 1.792 0 CA-C-O 118.613 -0.708 . . . . 0.0 109.14 171.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -166.68 14.44 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 115.981 1.845 . . . . 0.0 115.981 174.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 42.7 t -153.83 94.3 1.75 Allowed 'General case' 0 N--CA 1.499 2.019 0 CA-C-N 123.874 3.034 . . . . 0.0 117.973 -171.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.453 ' SG ' HG22 ' A' ' 57' ' ' VAL . 50.8 t -94.65 105.21 17.15 Favored 'General case' 0 CA--C 1.563 1.447 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 170.093 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.54 130.95 45.11 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 123.141 1.448 . . . . 0.0 112.824 -173.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 35.5 t60 -81.9 159.48 23.65 Favored 'General case' 0 CA--C 1.564 1.505 0 CA-C-O 122.815 1.293 . . . . 0.0 114.145 -174.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.3 p-10 -79.92 -51.42 9.12 Favored 'General case' 0 CA--C 1.57 1.717 0 CA-C-O 118.47 -0.776 . . . . 0.0 112.287 173.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -177.95 -65.37 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 124.589 1.156 . . . . 0.0 110.693 173.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 38.2 mm -133.01 -61.37 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 CA-C-N 121.042 1.746 . . . . 0.0 109.578 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.0 tp -71.06 102.4 2.45 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 120.192 1.36 . . . . 0.0 110.519 176.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 60.5 p -53.34 92.12 0.01 OUTLIER 'General case' 0 CA--C 1.573 1.856 1 N-CA-C 122.168 4.136 . . . . 0.0 122.168 -171.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 tt -125.5 87.03 2.63 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 101.865 -3.383 . . . . 0.0 101.865 171.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.7 m -99.98 136.39 39.96 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 -171.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -121.76 141.58 51.05 Favored 'General case' 0 CA--C 1.565 1.557 0 CA-C-N 114.707 -1.133 . . . . 0.0 108.347 174.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.7 m -79.55 146.31 32.69 Favored 'General case' 0 CA--C 1.556 1.174 0 O-C-N 119.492 -2.005 . . . . 0.0 113.831 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -135.64 -178.21 5.02 Favored 'General case' 0 CA--C 1.566 1.572 0 CA-C-N 113.841 -1.527 . . . . 0.0 113.996 -173.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.48 135.45 33.34 Favored 'General case' 0 CA--C 1.571 1.77 0 O-C-N 121.252 -0.905 . . . . 0.0 110.177 176.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.43 160.36 27.61 Favored 'General case' 0 CA--C 1.579 2.06 0 O-C-N 120.908 -1.12 . . . . 0.0 113.236 176.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.41 155.25 36.56 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 117.069 2.248 . . . . 0.0 117.069 -173.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 -117.18 175.77 5.45 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-N 112.889 -1.959 . . . . 0.0 110.696 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -58.38 128.1 35.45 Favored 'General case' 0 CA--C 1.57 1.748 0 O-C-N 120.651 -1.28 . . . . 0.0 113.631 -174.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 82.5 11.06 0.61 Allowed 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 125.748 1.619 . . . . 0.0 114.217 -173.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.7 t -110.36 147.16 34.5 Favored 'General case' 0 CA--C 1.563 1.458 0 O-C-N 120.143 -1.598 . . . . 0.0 111.988 175.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -80.11 110.56 15.63 Favored 'General case' 0 CA--C 1.57 1.734 0 CA-C-O 123.114 1.435 . . . . 0.0 112.449 -177.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.2 152.29 20.06 Favored 'General case' 0 CA--C 1.563 1.456 0 C-N-CA 125.926 1.69 . . . . 0.0 112.464 174.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.5 t -79.46 103.08 9.13 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 171.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.96 -38.51 69.76 Favored 'General case' 0 CA--C 1.566 1.562 0 N-CA-C 118.413 2.745 . . . . 0.0 118.413 -171.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.4 p90 -80.94 61.38 4.52 Favored 'General case' 0 CA--C 1.571 1.779 0 C-N-CA 124.728 1.211 . . . . 0.0 113.132 175.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.9 p -68.95 135.26 50.69 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 119.005 -2.309 . . . . 0.0 112.581 -174.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.307 0.5 OUTLIER -94.87 -135.32 0.2 Allowed 'General case' 0 CA--C 1.565 1.556 0 CA-C-N 111.551 -2.568 . . . . 0.0 107.272 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -139.45 73.57 1.44 Allowed 'General case' 0 CA--C 1.561 1.38 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 169.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -172.98 -140.6 3.2 Favored Glycine 0 N--CA 1.482 1.756 0 CA-C-N 115.3 -0.864 . . . . 0.0 113.333 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.453 HG22 ' SG ' ' A' ' 28' ' ' CYS . 3.4 t -87.56 142.98 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 CA-C-O 122.89 1.329 . . . . 0.0 111.139 -178.223 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -117.85 132.66 56.41 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-O 122.515 1.15 . . . . 0.0 110.353 -174.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -62.21 -43.68 98.28 Favored 'General case' 0 CA--C 1.581 2.148 0 CA-C-N 115.604 -0.725 . . . . 0.0 112.913 174.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -137.1 110.91 8.15 Favored 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 103.46 -2.793 . . . . 0.0 103.46 172.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 51.3 m -51.4 152.68 4.26 Favored Pre-proline 0 CA--C 1.593 2.605 0 N-CA-C 116.911 2.189 . . . . 0.0 116.911 -176.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.62 -173.8 0.4 Allowed 'Trans proline' 0 CA--C 1.572 2.407 0 C-N-CA 122.851 2.368 . . . . 0.0 116.619 -174.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 70.2 m -80.08 155.62 27.45 Favored 'General case' 0 CA--C 1.573 1.834 0 O-C-N 120.427 -1.42 . . . . 0.0 113.56 -178.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.86 -178.8 2.0 Favored 'General case' 0 CA--C 1.578 2.055 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 -175.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.95 112.46 3.31 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.364 -1.46 . . . . 0.0 112.562 -175.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 86.55 29.26 24.77 Favored Glycine 0 CA--C 1.556 2.637 0 N-CA-C 117.435 1.734 . . . . 0.0 117.435 -173.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.9 tp -141.11 141.35 34.21 Favored 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 118.812 1.306 . . . . 0.0 111.083 -176.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.74 158.32 16.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.674 -1.266 . . . . 0.0 113.219 -176.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 4.3 t -91.09 95.35 10.04 Favored 'General case' 0 CA--C 1.575 1.933 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 173.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -97.63 -55.8 2.71 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 118.561 2.8 . . . . 0.0 118.561 -171.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -78.97 68.28 3.1 Favored Glycine 0 N--CA 1.497 2.728 0 N-CA-C 116.942 1.537 . . . . 0.0 116.942 -173.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -72.94 105.65 4.52 Favored 'General case' 0 CA--C 1.565 1.552 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -170.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -87.06 67.56 9.77 Favored 'General case' 0 CA--C 1.573 1.864 0 C-N-CA 123.883 0.873 . . . . 0.0 109.216 174.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 89.0 p -138.61 81.32 1.84 Allowed 'General case' 0 CA--C 1.561 1.377 0 O-C-N 121.274 -0.891 . . . . 0.0 111.963 -173.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.7 mp -97.46 74.25 2.45 Favored 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 174.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . 0.389 2.9 p 57.58 -54.45 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 N-CA-C 117.82 2.526 . . . . 0.0 117.82 -174.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -151.4 64.73 0.37 Allowed Glycine 0 N--CA 1.487 2.089 0 C-N-CA 124.244 0.926 . . . . 0.0 111.795 173.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 96.9 p -84.88 74.72 10.45 Favored 'General case' 0 CA--C 1.568 1.671 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 -171.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 21.7 mm 68.31 114.5 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.141 0 C-N-CA 125.685 1.594 . . . . 0.0 111.505 178.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.8 p 57.25 -176.79 0.06 Allowed 'General case' 0 N--CA 1.505 2.275 0 CA-C-O 123.433 1.587 . . . . 0.0 114.512 178.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -64.96 3.26 0.59 Allowed 'General case' 0 CA--C 1.587 2.391 0 N-CA-C 117.604 2.446 . . . . 0.0 117.604 172.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 75.0 p -98.79 74.03 2.04 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 124.458 2.075 . . . . 0.0 112.666 -174.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -108.83 71.56 0.78 Allowed 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 111.91 -2.404 . . . . 0.0 107.082 173.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -126.33 167.75 15.08 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 124.059 0.944 . . . . 0.0 113.443 -171.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -125.01 160.46 19.63 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 118.184 2.034 . . . . 0.0 118.184 -177.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.5 mm -91.96 129.57 42.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 O-C-N 120.989 -1.301 . . . . 0.0 109.675 -172.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 54.6 m -64.04 124.52 21.81 Favored 'General case' 0 CA--C 1.567 1.618 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 177.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 72.8 m-70 -143.8 161.37 38.8 Favored 'General case' 0 CA--C 1.565 1.55 0 CA-C-O 123.462 1.601 . . . . 0.0 111.988 175.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -98.08 131.47 44.45 Favored 'General case' 0 CA--C 1.563 1.448 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.145 175.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.7 t -105.61 71.08 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.039 0 CA-C-O 123.068 1.413 . . . . 0.0 108.566 -179.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -89.06 68.84 2.71 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 115.542 0.977 . . . . 0.0 115.542 -176.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 16.8 ptm180 -70.67 -37.94 73.71 Favored 'General case' 0 CA--C 1.574 1.899 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 -177.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 41.7 t . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 123.98 1.848 . . . . 0.0 114.298 -176.547 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 63.4 t . . . . . 0 CA--C 1.578 2.041 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -67.86 -16.74 46.29 Favored 'Trans proline' 0 CA--C 1.573 2.445 0 N-CA-C 120.208 3.118 . . . . 0.0 120.208 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -104.68 138.2 19.44 Favored Pre-proline 0 CA--C 1.582 2.18 0 CA-C-O 117.973 -1.013 . . . . 0.0 112.418 -178.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.41 68.6 7.95 Favored 'Trans proline' 0 CA--C 1.575 2.525 0 C-N-CA 122.524 2.15 . . . . 0.0 116.131 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 42.9 tpt85 -99.16 83.79 2.93 Favored 'General case' 0 CA--C 1.565 1.544 0 O-C-N 120.863 -1.148 . . . . 0.0 108.984 175.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 92.19 -56.02 2.84 Favored Glycine 0 N--CA 1.499 2.859 0 N-CA-C 115.339 0.896 . . . . 0.0 115.339 -174.032 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 10.4 tt -68.25 93.34 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.574 1.896 0 C-N-CA 125.693 1.597 . . . . 0.0 111.014 169.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 60.2 mt -70.3 98.99 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.282 0 CA-C-O 122.249 1.023 . . . . 0.0 110.551 -174.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 22.6 pt -116.91 -176.32 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.579 2.077 0 C-N-CA 124.325 1.05 . . . . 0.0 111.675 -177.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.25 62.5 m-80 100.06 97.42 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 C-N-CA 127.516 2.326 . . . . 0.0 110.297 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -139.98 158.15 44.53 Favored 'General case' 0 CA--C 1.573 1.841 0 CA-C-O 122.771 1.272 . . . . 0.0 110.987 173.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -79.69 162.13 25.39 Favored 'General case' 0 CA--C 1.566 1.588 0 N-CA-C 115.237 1.569 . . . . 0.0 115.237 -173.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -78.18 126.51 30.91 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-O 122.403 1.097 . . . . 0.0 109.741 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 114.91 19.09 6.12 Favored Glycine 0 CA--C 1.559 2.79 0 N-CA-C 116.019 1.168 . . . . 0.0 116.019 -172.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -135.08 149.97 50.16 Favored 'General case' 0 CA--C 1.569 1.693 0 CA-C-N 119.215 1.507 . . . . 0.0 111.181 -178.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mp -73.48 147.21 44.31 Favored 'General case' 0 CA--C 1.575 1.926 0 N-CA-C 114.093 1.146 . . . . 0.0 114.093 -178.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 4.0 p -135.73 -175.08 3.84 Favored 'General case' 0 CA--C 1.574 1.901 0 CA-C-O 122.767 1.27 . . . . 0.0 114.234 -174.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.5 mt -109.31 -76.96 0.6 Allowed 'General case' 0 CA--C 1.575 1.921 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 170.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.2 p30 -96.1 -178.43 4.33 Favored 'General case' 0 CA--C 1.584 2.267 0 N-CA-C 114.908 1.448 . . . . 0.0 114.908 172.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 t -85.42 -17.54 36.3 Favored 'General case' 0 N--CA 1.503 2.206 0 N-CA-C 117.358 2.355 . . . . 0.0 117.358 174.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.14 9.75 2.35 Favored 'General case' 0 CA--C 1.577 1.998 0 N-CA-C 116.771 2.138 . . . . 0.0 116.771 174.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -97.0 -31.44 12.52 Favored 'General case' 0 CA--C 1.567 1.611 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.7 m -68.7 170.48 9.31 Favored 'General case' 0 CA--C 1.581 2.171 0 CA-C-N 121.232 1.833 . . . . 0.0 113.586 174.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -65.85 -65.25 0.7 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.034 -1.666 . . . . 0.0 108.751 172.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 83.4 p -83.65 107.49 16.13 Favored 'General case' 0 CA--C 1.566 1.588 0 N-CA-C 102.866 -3.013 . . . . 0.0 102.866 168.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -66.15 79.29 0.09 Allowed 'General case' 0 N--CA 1.501 2.089 0 CA-C-O 124.746 2.212 . . . . 0.0 115.596 -171.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 36.4 t -143.19 89.77 2.13 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 112.083 -2.326 . . . . 0.0 111.22 174.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.2 t -86.78 114.57 23.56 Favored 'General case' 0 CA--C 1.555 1.163 0 N-CA-C 102.688 -3.079 . . . . 0.0 102.688 169.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -96.97 123.65 40.74 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-O 123.525 1.631 . . . . 0.0 112.34 -171.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.449 ' HB2' HG12 ' A' ' 57' ' ' VAL . 13.5 t60 -83.18 141.85 31.62 Favored 'General case' 0 CA--C 1.558 1.286 0 CA-C-N 114.079 -1.419 . . . . 0.0 113.865 -174.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -68.51 17.26 0.04 OUTLIER 'General case' 0 CA--C 1.586 2.353 0 N-CA-C 117.46 2.393 . . . . 0.0 117.46 172.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.263 42.8 p 65.54 65.99 0.54 Allowed 'General case' 0 N--CA 1.499 2.023 0 C-N-CA 126.103 1.761 . . . . 0.0 112.866 -177.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.336 13.4 mt 78.62 151.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.511 2.597 0 C-N-CA 125.188 1.395 . . . . 0.0 110.256 -179.1 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.8 tp 66.46 75.4 0.33 Allowed 'General case' 0 N--CA 1.51 2.571 0 O-C-N 120.197 -1.564 . . . . 0.0 108.587 -172.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.0 p -48.11 100.56 0.02 OUTLIER 'General case' 0 CA--C 1.574 1.885 1 N-CA-C 123.457 4.614 . . . . 0.0 123.457 -170.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 30.6 tp -132.42 82.79 2.03 Favored 'General case' 0 CA--C 1.572 1.79 0 N-CA-C 101.645 -3.465 . . . . 0.0 101.645 170.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.0 m -99.85 131.72 45.65 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 -171.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -135.48 136.12 41.02 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 123.976 0.91 . . . . 0.0 110.981 -174.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 60.6 m -63.25 136.64 57.83 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 119.873 -1.767 . . . . 0.0 112.985 176.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.86 179.78 6.66 Favored 'General case' 0 CA--C 1.565 1.533 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -173.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -76.45 164.44 25.98 Favored 'General case' 0 CA--C 1.571 1.759 0 CA-C-O 122.417 1.103 . . . . 0.0 113.962 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.91 163.14 28.59 Favored 'General case' 0 CA--C 1.567 1.612 0 N-CA-C 115.078 1.51 . . . . 0.0 115.078 179.039 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.4 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . . . -81.03 142.84 32.98 Favored 'General case' 0 CA--C 1.564 1.489 0 CA-C-O 123.822 1.772 . . . . 0.0 113.434 177.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -96.65 164.14 12.71 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-N 113.739 -1.573 . . . . 0.0 112.173 -174.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -53.98 123.97 14.14 Favored 'General case' 0 CA--C 1.571 1.772 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -174.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 84.6 18.77 0.15 Allowed 'General case' 0 N--CA 1.508 2.444 0 C-N-CA 126.056 1.742 . . . . 0.0 113.949 -172.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.9 t -119.95 150.82 39.89 Favored 'General case' 0 CA--C 1.566 1.591 0 O-C-N 120.203 -1.56 . . . . 0.0 112.211 174.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -67.13 141.14 57.51 Favored 'General case' 0 CA--C 1.57 1.738 0 CA-C-O 122.886 1.327 . . . . 0.0 114.315 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -129.44 139.09 51.74 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-N 113.861 -1.518 . . . . 0.0 112.811 -176.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.8 t -87.82 85.56 7.05 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-O 122.171 0.986 . . . . 0.0 109.981 174.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.48 -33.05 64.63 Favored 'General case' 0 CA--C 1.571 1.752 0 N-CA-C 119.479 3.14 . . . . 0.0 119.479 -173.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -78.8 153.93 30.31 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 125.502 1.521 . . . . 0.0 112.915 174.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.1 p -112.44 125.4 54.17 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 123.338 1.542 . . . . 0.0 109.8 172.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.513 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.7 pt? -99.64 -159.41 0.74 Allowed 'General case' 0 CA--C 1.576 1.972 0 CA-C-N 112.655 -2.066 . . . . 0.0 106.738 171.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -112.49 64.42 0.63 Allowed 'General case' 0 N--CA 1.5 2.049 0 O-C-N 119.634 -1.916 . . . . 0.0 106.109 171.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 178.89 -165.83 35.1 Favored Glycine 0 CA--C 1.542 1.757 0 CA-C-N 113.724 -1.58 . . . . 0.0 114.872 -173.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.449 HG12 ' HB2' ' A' ' 30' ' ' HIS . 44.4 t -92.87 156.23 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 CA-C-O 123.314 1.531 . . . . 0.0 113.171 -166.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 17.6 m-30 -106.44 140.76 38.84 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 114.797 -1.092 . . . . 0.0 113.742 -176.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -71.58 -59.16 2.9 Favored 'General case' 0 CA--C 1.575 1.911 0 O-C-N 121.23 -0.919 . . . . 0.0 113.051 175.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.96 119.62 30.95 Favored 'General case' 0 CA--C 1.567 1.621 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 174.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 55.1 m -49.46 153.34 1.92 Allowed Pre-proline 0 CA--C 1.588 2.432 0 N-CA-C 120.064 3.357 . . . . 0.0 120.064 -177.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -58.23 169.47 2.9 Favored 'Trans proline' 0 CA--C 1.573 2.453 0 C-N-CA 123.216 2.611 . . . . 0.0 115.573 172.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 2.7 m -94.02 107.16 19.1 Favored 'General case' 0 CA--C 1.577 1.985 0 O-C-N 120.397 -1.439 . . . . 0.0 109.19 175.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.401 0.0 OUTLIER -83.86 -63.16 1.4 Allowed 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 120.961 3.689 . . . . 0.0 120.961 -171.32 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.89 82.11 7.65 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.245 -1.535 . . . . 0.0 114.957 -173.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 71.24 33.26 64.85 Favored Glycine 0 N--CA 1.495 2.616 0 N-CA-C 119.339 2.495 . . . . 0.0 119.339 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.4 mp -122.33 143.98 49.29 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 122.51 1.147 . . . . 0.0 111.464 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.63 155.82 17.86 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 122.227 1.013 . . . . 0.0 112.55 177.325 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 3.5 t -94.88 86.99 4.83 Favored 'General case' 0 CA--C 1.575 1.941 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.421 175.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -96.42 110.58 22.91 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.514 -1.366 . . . . 0.0 112.98 -173.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 142.95 75.4 0.03 OUTLIER Glycine 0 N--CA 1.493 2.445 0 O-C-N 121.284 -0.885 . . . . 0.0 112.954 175.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.25 -10.31 0.03 OUTLIER 'General case' 0 CA--C 1.583 2.239 0 N-CA-C 119.785 3.254 . . . . 0.0 119.785 -178.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 62.55 -100.46 0.09 Allowed 'General case' 0 N--CA 1.501 2.095 0 CA-C-N 121.353 1.888 . . . . 0.0 109.026 -173.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 94.4 p -135.92 12.75 3.38 Favored 'General case' 0 CA--C 1.574 1.901 0 N-CA-C 115.954 1.835 . . . . 0.0 115.954 174.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.2 pp -66.79 -31.12 71.55 Favored 'General case' 0 N--CA 1.5 2.065 0 N-CA-C 117.067 2.247 . . . . 0.0 117.067 -176.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.7 p -83.83 74.53 0.98 Allowed 'Isoleucine or valine' 0 CA--C 1.577 2.005 0 CA-C-O 123.516 1.627 . . . . 0.0 110.098 174.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -163.11 88.75 0.1 Allowed Glycine 0 N--CA 1.484 1.885 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.692 -174.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.2 m -70.42 123.25 21.3 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 178.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.258 17.1 mt 78.91 -77.14 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 C-N-CA 124.921 1.288 . . . . 0.0 108.136 -174.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 3.1 p -91.91 134.32 34.89 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 122.793 1.282 . . . . 0.0 112.626 174.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.75 76.76 7.64 Favored 'General case' 0 CA--C 1.571 1.77 0 CA-C-O 122.896 1.332 . . . . 0.0 109.401 173.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.2 m -96.68 -14.28 22.19 Favored 'General case' 0 CA--C 1.573 1.84 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -173.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -75.05 147.2 40.87 Favored 'General case' 0 CA--C 1.57 1.734 0 CA-C-O 122.463 1.125 . . . . 0.0 110.314 173.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -131.45 149.39 52.55 Favored 'General case' 0 CA--C 1.57 1.745 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.376 179.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -89.95 155.24 24.42 Favored Glycine 0 N--CA 1.499 2.867 0 O-C-N 120.922 -1.111 . . . . 0.0 114.614 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 29.5 mm -94.45 130.83 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 120.232 -1.746 . . . . 0.0 110.931 -170.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.4 ' SG ' ' HB3' ' A' ' 43' ' ' ALA . 95.8 m -61.11 120.53 10.48 Favored 'General case' 0 CA--C 1.566 1.576 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 175.109 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -144.52 143.54 30.9 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 122.481 1.134 . . . . 0.0 110.617 174.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -95.67 77.32 3.28 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 124.279 1.99 . . . . 0.0 111.792 -174.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.9 m -69.41 -15.27 19.36 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.991 0 N-CA-C 117.161 2.282 . . . . 0.0 117.161 -177.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -77.61 -37.48 30.57 Favored Glycine 0 CA--C 1.552 2.4 0 N-CA-C 117.782 1.873 . . . . 0.0 117.782 174.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 35.1 ptt180 -141.49 -56.72 0.48 Allowed 'General case' 0 CA--C 1.574 1.875 0 CA-C-N 119.338 1.569 . . . . 0.0 113.765 178.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 124.043 1.878 . . . . 0.0 114.007 -174.405 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 95.3 t . . . . . 0 CA--C 1.578 2.039 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -81.2 74.96 5.23 Favored 'Trans proline' 0 CA--C 1.571 2.365 0 C-N-CA 122.356 2.038 . . . . 0.0 114.537 -179.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -102.9 109.28 60.98 Favored Pre-proline 0 CA--C 1.577 2.007 0 CA-C-O 117.88 -1.057 . . . . 0.0 111.069 -178.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -72.22 -11.46 26.93 Favored 'Trans proline' 0 CA--C 1.575 2.546 0 N-CA-C 118.403 2.424 . . . . 0.0 118.403 175.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 84.5 mtm180 72.13 -53.72 0.69 Allowed 'General case' 0 N--CA 1.503 2.213 0 C-N-CA 126.112 1.765 . . . . 0.0 115.671 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 97.51 56.2 1.12 Allowed Glycine 0 N--CA 1.493 2.445 0 N-CA-C 116.037 1.175 . . . . 0.0 116.037 -174.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 10.2 tp -82.48 74.43 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.574 1.885 0 C-N-CA 124.631 1.172 . . . . 0.0 111.916 -178.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 38.9 mm 80.18 138.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.389 0 C-N-CA 125.546 1.538 . . . . 0.0 109.5 -174.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 20.1 pt -92.63 144.29 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 CA-C-O 123.013 1.387 . . . . 0.0 111.355 -177.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 -148.29 106.22 3.71 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.285 -177.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.2 tp -154.05 118.63 4.91 Favored 'General case' 0 CA--C 1.574 1.895 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 175.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -74.04 164.82 26.14 Favored 'General case' 0 CA--C 1.569 1.695 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -173.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 mp0 -69.86 132.84 46.64 Favored 'General case' 0 CA--C 1.567 1.604 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.891 -174.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.04 -10.29 51.46 Favored Glycine 0 N--CA 1.497 2.703 0 N-CA-C 117.18 1.632 . . . . 0.0 117.18 -173.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -99.23 144.11 28.73 Favored 'General case' 0 CA--C 1.566 1.569 0 CA-C-N 118.983 1.392 . . . . 0.0 110.843 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.5 mp -67.29 136.21 54.53 Favored 'General case' 0 CA--C 1.575 1.915 0 N-CA-C 113.904 1.075 . . . . 0.0 113.904 -175.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 11.7 p -137.92 144.57 41.34 Favored 'General case' 0 CA--C 1.565 1.522 0 C-N-CA 124.034 0.934 . . . . 0.0 112.122 -177.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 78.1 mt -82.99 -66.1 0.93 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.253 -0.904 . . . . 0.0 112.155 176.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -98.76 165.33 11.84 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 120.002 1.274 . . . . 0.0 113.198 174.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -74.92 -13.4 60.53 Favored 'General case' 0 N--CA 1.506 2.371 0 N-CA-C 116.301 1.963 . . . . 0.0 116.301 172.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.55 30.79 0.41 Allowed 'General case' 0 CA--C 1.58 2.098 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 172.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -127.95 -23.76 3.3 Favored 'General case' 0 CA--C 1.571 1.751 0 CA-C-O 116.767 -1.587 . . . . 0.0 114.863 -175.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 57.0 m -73.31 -144.99 0.02 OUTLIER 'General case' 0 CA--C 1.587 2.402 0 CA-C-N 122.23 2.287 . . . . 0.0 113.254 176.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -83.57 -67.64 0.77 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 118.759 -2.463 . . . . 0.0 114.233 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 61.9 p -84.66 -74.21 0.4 Allowed 'General case' 0 CA--C 1.566 1.584 0 O-C-N 121.248 -0.908 . . . . 0.0 111.235 174.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.5 t-20 -172.76 77.8 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 C-N-CA 124.731 1.212 . . . . 0.0 109.521 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.8 t -160.29 98.04 1.26 Allowed 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 121.259 1.845 . . . . 0.0 115.798 173.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.8 t -101.11 117.43 34.99 Favored 'General case' 0 CA--C 1.562 1.405 0 N-CA-C 103.046 -2.946 . . . . 0.0 103.046 169.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 65.1 tp60 -94.94 113.09 24.76 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.363 1.065 . . . . 0.0 113.739 -173.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.534 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.1 t60 -81.85 135.01 35.46 Favored 'General case' 0 CA--C 1.56 1.361 0 CA-C-N 114.741 -1.118 . . . . 0.0 111.119 176.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.4 p-10 -73.09 -75.53 0.14 Allowed 'General case' 0 CA--C 1.574 1.885 0 CA-C-O 118.326 -0.845 . . . . 0.0 113.043 174.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.5 t -169.5 92.6 0.25 Allowed 'General case' 0 N--CA 1.502 2.142 0 CA-C-N 120.906 1.685 . . . . 0.0 111.51 -177.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.305 3.8 mp 70.65 -69.06 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 C-N-CA 125.427 1.491 . . . . 0.0 111.348 174.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.4 mp -69.08 109.56 4.07 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 120.304 1.411 . . . . 0.0 107.697 173.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 56.7 p -72.2 83.57 1.02 Allowed 'General case' 0 CA--C 1.567 1.617 0 N-CA-C 120.502 3.519 . . . . 0.0 120.502 -171.371 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.7 tp -104.99 81.13 1.7 Allowed 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 103.305 -2.85 . . . . 0.0 103.305 170.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 26.9 m -100.58 124.17 45.79 Favored 'General case' 0 CA--C 1.564 1.495 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -170.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 65.6 mtt85 -114.33 167.85 10.35 Favored 'General case' 0 N--CA 1.501 2.102 0 C-N-CA 124.05 0.94 . . . . 0.0 111.601 174.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 83.4 m -79.95 147.86 31.44 Favored 'General case' 0 CA--C 1.568 1.649 0 O-C-N 118.565 -2.584 . . . . 0.0 111.104 172.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.91 172.43 12.7 Favored 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 -174.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.1 mt -85.25 152.67 23.14 Favored 'General case' 0 CA--C 1.568 1.663 0 CA-C-O 122.2 1.0 . . . . 0.0 113.034 -178.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -64.88 146.31 55.08 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 178.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.91 155.11 33.05 Favored 'General case' 0 CA--C 1.564 1.504 0 CA-C-O 123.398 1.571 . . . . 0.0 114.848 -175.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -108.33 172.66 6.71 Favored 'General case' 0 CA--C 1.562 1.422 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.448 -174.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -52.7 126.72 20.78 Favored 'General case' 0 CA--C 1.572 1.814 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 -174.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 74.51 20.11 2.55 Favored 'General case' 0 N--CA 1.506 2.347 0 N-CA-C 114.858 1.429 . . . . 0.0 114.858 -173.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 37.3 t -115.41 153.37 31.18 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 120.524 -1.36 . . . . 0.0 111.188 174.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -64.46 136.92 57.55 Favored 'General case' 0 CA--C 1.57 1.722 0 CA-C-O 123.18 1.467 . . . . 0.0 113.017 176.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.463 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 17.0 p -138.19 139.96 39.56 Favored 'General case' 0 CA--C 1.559 1.312 0 CA-C-N 113.194 -1.821 . . . . 0.0 112.436 -176.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.1 t -75.14 90.39 2.53 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 122.991 1.377 . . . . 0.0 110.704 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.565 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . . . -76.56 -51.04 12.41 Favored 'General case' 0 CA--C 1.568 1.65 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 -173.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 54.0 p90 -79.25 -37.26 38.38 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 117.193 2.294 . . . . 0.0 117.193 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 80.4 p 62.84 144.04 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 127.034 2.134 . . . . 0.0 114.644 -174.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.23 -168.36 1.55 Allowed 'General case' 0 CA--C 1.567 1.632 0 CA-C-N 113.934 -1.485 . . . . 0.0 108.436 171.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -103.42 74.3 1.26 Allowed 'General case' 0 CA--C 1.567 1.62 0 N-CA-C 105.191 -2.152 . . . . 0.0 105.191 171.049 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 166.42 -160.18 33.68 Favored Glycine 0 N--CA 1.482 1.701 0 CA-C-O 122.388 0.993 . . . . 0.0 115.079 -174.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.534 HG12 ' HB2' ' A' ' 30' ' ' HIS . 13.3 t -83.91 143.98 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 CA-C-O 122.935 1.35 . . . . 0.0 112.32 -167.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -109.24 135.18 50.76 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.916 -174.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -74.51 -17.58 60.73 Favored 'General case' 0 CA--C 1.589 2.447 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 173.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm -147.67 119.21 7.94 Favored 'General case' 0 CA--C 1.572 1.817 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 174.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 74.4 m -55.51 151.11 21.79 Favored Pre-proline 0 CA--C 1.586 2.357 0 N-CA-C 117.366 2.358 . . . . 0.0 117.366 177.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -66.79 172.88 8.89 Favored 'Trans proline' 0 CA--C 1.576 2.61 0 C-N-CA 122.464 2.109 . . . . 0.0 115.623 174.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 34.1 m -74.7 154.67 38.34 Favored 'General case' 0 CA--C 1.579 2.065 0 O-C-N 120.63 -1.294 . . . . 0.0 114.481 -178.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.41 179.15 7.85 Favored 'General case' 0 CA--C 1.576 1.957 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 179.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -65.81 103.44 0.9 Allowed 'General case' 0 CA--C 1.572 1.813 0 O-C-N 120.49 -1.381 . . . . 0.0 113.02 -176.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 129.79 -45.68 1.12 Allowed Glycine 0 N--CA 1.494 2.559 0 CA-C-N 115.224 -0.898 . . . . 0.0 114.816 -173.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mp -93.75 139.44 30.84 Favored 'General case' 0 CA--C 1.562 1.411 0 CA-C-O 122.707 1.242 . . . . 0.0 111.338 -176.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.32 151.24 21.28 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 121.787 0.803 . . . . 0.0 112.414 -177.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.565 ' SG ' ' HB2' ' A' ' 51' ' ' ALA . 8.8 t -92.13 124.36 36.16 Favored 'General case' 0 CA--C 1.567 1.621 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.527 173.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -92.68 96.78 10.38 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.702 -1.249 . . . . 0.0 107.672 -176.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.01 39.41 0.09 OUTLIER Glycine 0 N--CA 1.497 2.741 1 N-CA-C 124.6 4.6 . . . . 0.0 124.6 -172.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -88.51 101.45 13.94 Favored 'General case' 0 CA--C 1.567 1.617 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 161.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -67.69 90.28 0.27 Allowed 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 -173.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.1 p 45.26 43.32 8.02 Favored 'General case' 0 CA--C 1.576 1.943 0 N-CA-C 118.208 2.67 . . . . 0.0 118.208 -178.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.8 mt -72.55 -27.02 61.96 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 116.044 1.868 . . . . 0.0 116.044 -175.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 67.0 t -74.41 -27.14 20.98 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.24 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 174.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -150.01 76.04 0.25 Allowed Glycine 0 N--CA 1.49 2.286 0 CA-C-N 119.815 1.188 . . . . 0.0 114.624 177.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 86.8 p -85.09 91.11 8.02 Favored 'General case' 0 CA--C 1.57 1.727 0 CA-C-O 121.378 0.609 . . . . 0.0 112.388 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 19.9 tt -137.02 -69.23 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 C-N-CA 123.676 0.79 . . . . 0.0 110.17 -178.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 26.5 p -70.47 163.56 26.54 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 120.886 -1.134 . . . . 0.0 112.417 174.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -76.6 59.41 1.51 Allowed 'General case' 0 CA--C 1.581 2.165 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 -178.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 41.6 p -139.08 75.2 1.5 Allowed 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 123.83 1.776 . . . . 0.0 110.119 -178.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 19.7 p-10 -84.6 77.38 10.05 Favored 'General case' 0 N--CA 1.496 1.834 0 CA-C-N 113.365 -1.743 . . . . 0.0 111.122 178.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -134.79 160.09 39.3 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 -172.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.12 -179.26 52.53 Favored Glycine 0 N--CA 1.493 2.454 0 O-C-N 121.786 -0.571 . . . . 0.0 113.677 172.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.0 mm -115.59 137.08 50.35 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.536 0 CA-C-N 119.455 1.627 . . . . 0.0 111.62 -174.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.463 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 57.0 m -69.56 126.83 30.92 Favored 'General case' 0 CA--C 1.569 1.696 0 O-C-N 120.813 -1.179 . . . . 0.0 114.179 174.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -141.33 156.05 45.88 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 122.905 1.336 . . . . 0.0 111.115 176.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -93.68 77.11 4.31 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-O 124.097 1.903 . . . . 0.0 111.629 -174.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 93.0 t -118.63 -70.3 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 CA-C-N 112.246 -2.252 . . . . 0.0 109.04 -177.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.79 96.15 0.1 Allowed Glycine 0 N--CA 1.48 1.608 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -177.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -41.72 -39.29 1.66 Allowed 'General case' 0 N--CA 1.504 2.226 0 N-CA-C 120.005 3.335 . . . . 0.0 120.005 -175.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 115.92 1.822 . . . . 0.0 115.92 178.13 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 95.9 t . . . . . 0 CA--C 1.583 2.248 0 CA-C-O 115.409 -2.234 . . . . 0.0 112.187 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -70.21 95.33 0.59 Allowed 'Trans proline' 0 CA--C 1.57 2.312 0 CA-C-N 126.24 3.264 . . . . 0.0 115.497 -178.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -107.62 107.4 60.3 Favored Pre-proline 0 CA--C 1.577 2.014 0 CA-C-O 117.771 -1.109 . . . . 0.0 110.27 178.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -69.08 86.28 0.49 Allowed 'Trans proline' 0 CA--C 1.571 2.374 0 C-N-CA 122.834 2.356 . . . . 0.0 116.104 178.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -84.93 -48.86 8.87 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -177.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 147.52 -101.08 0.23 Allowed Glycine 0 N--CA 1.484 1.845 0 O-C-N 121.091 -1.005 . . . . 0.0 112.409 176.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 50.1 mm -125.56 89.82 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 -177.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 16.0 tt -89.99 50.9 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.477 0 CA-C-O 122.534 1.159 . . . . 0.0 112.948 174.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.298 40.5 mm -122.15 -93.35 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.575 1.929 0 N-CA-C 104.814 -2.291 . . . . 0.0 104.814 -175.523 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 35.06 87.79 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.15 0 N-CA-C 120.844 3.646 . . . . 0.0 120.844 172.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.4 tp -127.81 127.29 43.26 Favored 'General case' 0 CA--C 1.58 2.106 0 O-C-N 120.679 -1.263 . . . . 0.0 108.985 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -76.13 158.73 31.43 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 119.961 -1.712 . . . . 0.0 114.895 -174.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.26 136.22 54.59 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 122.028 0.918 . . . . 0.0 111.216 176.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.96 -7.85 67.56 Favored Glycine 0 CA--C 1.557 2.69 0 N-CA-C 116.558 1.383 . . . . 0.0 116.558 -172.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -97.66 142.72 29.12 Favored 'General case' 0 CA--C 1.567 1.599 0 CA-C-N 119.026 1.413 . . . . 0.0 110.167 178.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.4 mp -63.99 128.09 34.28 Favored 'General case' 0 CA--C 1.573 1.835 0 CA-C-O 122.14 0.971 . . . . 0.0 112.455 -178.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -129.11 157.85 40.6 Favored 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 123.741 1.734 . . . . 0.0 113.57 -173.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.3 mt -102.76 -64.97 1.02 Allowed 'General case' 0 CA--C 1.573 1.849 0 CA-C-N 114.269 -1.332 . . . . 0.0 107.598 170.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -98.97 148.83 23.59 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.481 ' HA ' ' HB2' ' A' ' 28' ' ' CYS . 2.8 t -68.29 -22.65 64.72 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 119.819 -1.801 . . . . 0.0 112.842 169.184 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . 0.3 . . -71.68 3.4 4.09 Favored 'General case' 0 CA--C 1.58 2.121 0 N-CA-C 115.725 1.75 . . . . 0.0 115.725 171.154 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -99.83 -37.52 9.03 Favored 'General case' 0 CA--C 1.575 1.928 0 C-N-CA 126.05 1.74 . . . . 0.0 113.206 173.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 12.5 m -76.46 157.37 32.27 Favored 'General case' 0 CA--C 1.572 1.795 0 N-CA-C 116.507 2.04 . . . . 0.0 116.507 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -68.54 -59.65 2.99 Favored 'General case' 0 N--CA 1.501 2.084 0 C-N-CA 124.307 1.043 . . . . 0.0 109.016 172.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.7 t -81.52 104.38 11.9 Favored 'General case' 0 CA--C 1.565 1.534 0 N-CA-C 103.0 -2.963 . . . . 0.0 103.0 168.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -70.88 82.01 0.65 Allowed 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 124.528 2.109 . . . . 0.0 113.071 -172.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 28.8 t -155.92 81.56 1.01 Allowed 'General case' 0 CA--C 1.56 1.336 0 CA-C-N 112.157 -2.292 . . . . 0.0 109.99 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.481 ' HB2' ' HA ' ' A' ' 20' ' ' SER . 18.0 t -78.84 114.2 17.57 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 104.785 -2.302 . . . . 0.0 104.785 172.03 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.03 109.27 16.21 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -171.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.461 ' HB2' HG12 ' A' ' 57' ' ' VAL . 39.4 t-80 -77.35 108.37 10.44 Favored 'General case' 0 CA--C 1.564 1.489 0 CA-C-O 122.244 1.021 . . . . 0.0 111.132 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.1 p-10 -64.82 42.71 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.341 0 N-CA-C 119.115 3.005 . . . . 0.0 119.115 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.8 p 67.17 84.22 0.16 Allowed 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 126.049 1.74 . . . . 0.0 113.725 173.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.273 4.3 mp 72.49 -48.56 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 C-N-CA 125.292 1.437 . . . . 0.0 113.63 177.099 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.8 mt -51.68 -27.47 11.79 Favored 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 118.33 2.715 . . . . 0.0 118.33 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . 0.251 28.4 p 76.73 -2.6 2.66 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 118.988 2.958 . . . . 0.0 118.988 174.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.5 mp -73.95 95.01 2.41 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 121.041 1.746 . . . . 0.0 106.735 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.6 m -96.55 158.55 15.38 Favored 'General case' 0 CA--C 1.567 1.616 0 CA-C-O 122.874 1.321 . . . . 0.0 113.961 -170.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -141.55 138.39 32.65 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.675 -1.265 . . . . 0.0 110.922 -178.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 67.3 m -63.22 143.48 57.76 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 118.448 -2.658 . . . . 0.0 113.721 176.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -141.95 171.86 13.49 Favored 'General case' 0 CA--C 1.564 1.509 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -173.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -108.02 149.26 28.63 Favored 'General case' 0 CA--C 1.569 1.68 0 CA-C-N 114.481 -1.236 . . . . 0.0 110.793 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -53.38 142.59 21.24 Favored 'General case' 0 CA--C 1.577 2.007 0 N-CA-C 116.372 1.99 . . . . 0.0 116.372 176.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.4 168.79 19.43 Favored 'General case' 0 CA--C 1.574 1.882 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -174.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 63.1 mtt-85 -116.44 162.86 16.91 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.011 -1.056 . . . . 0.0 112.183 -177.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -55.4 126.76 26.48 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -175.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.265 66.9 m-80 77.76 20.82 1.01 Allowed 'General case' 0 CA--C 1.584 2.254 0 C-N-CA 125.267 1.427 . . . . 0.0 114.464 -173.15 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.0 t -119.51 155.15 32.68 Favored 'General case' 0 CA--C 1.565 1.529 0 O-C-N 120.477 -1.389 . . . . 0.0 110.742 173.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -61.93 130.01 43.64 Favored 'General case' 0 CA--C 1.566 1.568 0 CA-C-O 123.21 1.481 . . . . 0.0 114.479 -176.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.546 ' SG ' ' HA ' ' A' ' 62' ' ' PRO . 23.4 t -133.48 145.29 50.07 Favored 'General case' 0 CA--C 1.568 1.669 0 CA-C-N 113.022 -1.899 . . . . 0.0 112.752 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.5 m -120.57 137.65 54.29 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 105.245 -2.131 . . . . 0.0 105.245 171.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -82.07 -132.32 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.144 0 O-C-N 120.512 -1.368 . . . . 0.0 113.464 -174.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -133.15 156.25 47.8 Favored 'General case' 0 N--CA 1.491 1.584 1 N-CA-C 125.108 5.225 . . . . 0.0 125.108 -169.086 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.351 70.3 p 63.94 128.0 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.133 1 CA-C-N 108.115 -4.129 . . . . 0.0 115.165 -178.058 . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.346 0.4 OUTLIER -142.85 -81.08 0.2 Allowed 'General case' 0 CA--C 1.582 2.194 1 CA-C-N 108.228 -4.078 . . . . 0.0 100.683 -173.883 . . . . . . . . 4 3 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -159.22 -16.29 0.06 Allowed 'General case' 0 CA--C 1.611 3.312 0 C-N-CA 130.194 3.398 . . . . 0.0 107.907 169.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 118.0 58.48 0.28 Allowed Glycine 0 CA--C 1.562 2.982 0 C-N-CA 125.373 1.463 . . . . 0.0 113.773 -170.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.461 HG12 ' HB2' ' A' ' 30' ' ' HIS . 16.9 t -145.15 141.45 22.81 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.756 0 CA-C-N 121.791 2.796 . . . . 0.0 106.088 139.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -125.8 131.29 52.49 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 120.782 -1.198 . . . . 0.0 113.686 -172.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -69.1 -29.66 67.79 Favored 'General case' 0 CA--C 1.579 2.059 0 N-CA-C 116.133 1.901 . . . . 0.0 116.133 179.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -149.56 125.32 10.46 Favored 'General case' 0 CA--C 1.57 1.736 0 N-CA-C 105.823 -1.918 . . . . 0.0 105.823 174.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.2 m -55.23 152.19 16.15 Favored Pre-proline 0 CA--C 1.596 2.746 0 N-CA-C 116.797 2.147 . . . . 0.0 116.797 -175.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.546 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 44.2 Cg_endo -78.45 37.48 0.64 Allowed 'Trans proline' 0 CA--C 1.569 2.271 1 N-CA-C 122.786 4.11 . . . . 0.0 122.786 -171.188 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.478 ' SG ' ' SG ' ' A' ' 49' ' ' CYS . 29.8 m 64.42 144.17 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 -178.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -66.24 145.94 55.19 Favored 'General case' 0 CA--C 1.569 1.677 0 O-C-N 119.816 -1.802 . . . . 0.0 112.961 176.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -62.97 119.76 10.06 Favored 'General case' 0 CA--C 1.565 1.538 0 CA-C-O 123.737 1.732 . . . . 0.0 114.628 -172.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 138.69 -48.76 0.86 Allowed Glycine 0 N--CA 1.49 2.299 0 CA-C-N 112.461 -2.154 . . . . 0.0 113.804 -172.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -105.08 173.69 6.2 Favored 'General case' 0 CA--C 1.575 1.915 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 175.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -100.64 155.1 18.07 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -173.616 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 37.3 t -96.36 127.8 42.69 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-N 113.324 -1.762 . . . . 0.0 110.895 172.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -97.75 151.36 20.24 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 120.728 1.604 . . . . 0.0 111.649 174.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -124.7 83.44 0.35 Allowed Glycine 0 N--CA 1.495 2.606 0 O-C-N 120.783 -1.198 . . . . 0.0 112.562 176.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -85.55 76.59 10.01 Favored 'General case' 0 CA--C 1.572 1.793 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 -170.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.85 71.17 0.5 Allowed 'General case' 0 N--CA 1.504 2.234 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 174.774 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 50.1 m -74.39 -51.37 15.2 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 114.843 1.423 . . . . 0.0 114.843 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.14 75.57 10.31 Favored 'General case' 0 CA--C 1.571 1.767 0 CA-C-N 119.558 1.072 . . . . 0.0 110.248 174.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.491 HG13 ' H ' ' A' ' 77' ' ' GLY 0.322 14.8 p -103.58 -106.35 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.57 1.72 0 C-N-CA 124.009 0.924 . . . . 0.0 110.069 -176.61 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.491 ' H ' HG13 ' A' ' 76' ' ' VAL . . . 179.9 82.72 0.06 OUTLIER Glycine 0 N--CA 1.488 2.165 0 O-C-N 120.699 -1.251 . . . . 0.0 115.331 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.9 t -134.88 -131.5 0.16 Allowed 'General case' 0 CA--C 1.575 1.909 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 172.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.269 0.0 OUTLIER -80.29 -65.39 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.226 0 O-C-N 120.234 -1.541 . . . . 0.0 108.527 173.431 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.4 p -116.46 135.1 54.12 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 122.895 1.331 . . . . 0.0 109.486 173.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 46.3 m-20 -82.43 65.68 7.68 Favored 'General case' 0 CA--C 1.573 1.858 0 CA-C-O 122.819 1.295 . . . . 0.0 113.512 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 40.6 p -125.1 75.98 1.5 Allowed 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 123.953 1.835 . . . . 0.0 109.508 177.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -123.73 98.18 5.7 Favored 'General case' 0 CA--C 1.566 1.558 0 CA-C-N 112.366 -2.197 . . . . 0.0 107.583 -177.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -107.76 161.0 15.29 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-O 122.039 0.923 . . . . 0.0 112.213 -173.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -86.76 -164.32 39.76 Favored Glycine 0 N--CA 1.487 2.046 0 O-C-N 121.071 -1.018 . . . . 0.0 115.457 175.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 33.9 mm -125.89 152.71 33.26 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.058 0 CA-C-O 122.882 1.325 . . . . 0.0 110.29 -174.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.457 ' SG ' ' HB2' ' A' ' 49' ' ' CYS . 58.6 m -76.11 122.09 23.77 Favored 'General case' 0 CA--C 1.57 1.722 0 O-C-N 120.312 -1.493 . . . . 0.0 112.379 172.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -138.51 143.01 39.34 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 123.414 1.578 . . . . 0.0 111.092 178.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 -98.93 137.14 37.91 Favored 'General case' 0 CA--C 1.56 1.355 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.578 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 57.9 t -110.96 -87.79 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.45 -174.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.57 84.86 0.36 Allowed Glycine 0 N--CA 1.493 2.46 0 N-CA-C 115.46 0.944 . . . . 0.0 115.46 -178.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.0 108.87 1.31 Allowed 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 117.8 0.8 . . . . 0.0 112.557 -176.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 62.2 p . . . . . 0 N--CA 1.489 1.518 0 CA-C-O 123.266 1.508 . . . . 0.0 110.497 -174.268 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 CA--C 1.577 2.005 0 CA-C-O 118.961 -0.542 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -73.51 53.32 2.63 Favored 'Trans proline' 0 CA--C 1.578 2.704 0 C-N-CA 122.712 2.275 . . . . 0.0 117.063 177.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -138.85 75.51 36.09 Favored Pre-proline 0 CA--C 1.579 2.061 0 O-C-N 120.441 -1.412 . . . . 0.0 112.683 -174.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -71.7 -65.09 0.03 OUTLIER 'Trans proline' 0 CA--C 1.571 2.33 0 C-N-CA 122.436 2.09 . . . . 0.0 113.878 176.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 42.0 ttp180 -99.83 75.7 1.91 Allowed 'General case' 0 CA--C 1.571 1.764 0 O-C-N 121.22 -0.925 . . . . 0.0 108.905 173.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.34 84.24 0.08 OUTLIER Glycine 0 N--CA 1.487 2.096 0 O-C-N 121.069 -1.02 . . . . 0.0 115.634 -176.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 5.1 mp -97.18 83.21 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 N-CA-C 105.679 -1.971 . . . . 0.0 105.679 171.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 21.3 pt -85.57 122.68 38.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 CA-C-O 122.338 1.066 . . . . 0.0 112.164 -174.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.9 pt -100.12 -174.52 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.582 2.204 0 C-N-CA 123.893 0.877 . . . . 0.0 111.65 177.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 94.95 86.98 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 127.382 2.273 . . . . 0.0 112.642 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -138.41 157.39 46.31 Favored 'General case' 0 CA--C 1.573 1.849 0 CA-C-O 122.664 1.221 . . . . 0.0 111.941 172.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -78.11 167.19 21.82 Favored 'General case' 0 CA--C 1.569 1.693 0 O-C-N 120.337 -1.477 . . . . 0.0 113.961 -175.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -74.82 148.32 40.38 Favored 'General case' 0 CA--C 1.578 2.02 0 CA-C-O 122.312 1.053 . . . . 0.0 110.762 174.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.52 28.2 10.74 Favored Glycine 0 CA--C 1.56 2.888 0 N-CA-C 114.979 0.752 . . . . 0.0 114.979 -171.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -139.39 146.22 39.91 Favored 'General case' 0 CA--C 1.568 1.636 0 C-N-CA 125.157 1.383 . . . . 0.0 109.698 -175.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.2 tt -69.68 119.18 13.52 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 120.657 -1.277 . . . . 0.0 111.721 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 14.6 p -120.92 158.42 27.72 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 -175.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -88.64 -84.79 0.2 Allowed 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 174.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.7 p30 -94.03 169.78 10.02 Favored 'General case' 0 N--CA 1.499 2.004 0 C-N-CA 124.021 0.928 . . . . 0.0 113.11 173.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.7 m -72.03 -23.08 61.33 Favored 'General case' 0 N--CA 1.504 2.261 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 174.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.28 12.06 1.04 Allowed 'General case' 0 CA--C 1.583 2.245 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 173.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 31.3 mm100 -93.1 -47.56 6.91 Favored 'General case' 0 CA--C 1.569 1.702 0 C-N-CA 125.05 1.34 . . . . 0.0 112.737 174.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 70.9 m -72.55 154.28 40.88 Favored 'General case' 0 CA--C 1.57 1.75 0 CA-C-N 120.451 1.478 . . . . 0.0 113.705 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 45.2 mtpt -54.44 -57.39 11.5 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.944 -1.097 . . . . 0.0 111.1 174.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.1 m -83.75 106.31 15.35 Favored 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 103.606 -2.739 . . . . 0.0 103.606 168.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -68.89 85.0 0.32 Allowed 'General case' 0 N--CA 1.495 1.804 0 CA-C-O 124.185 1.945 . . . . 0.0 113.718 -173.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.7 t -151.66 73.12 1.06 Allowed 'General case' 0 CA--C 1.564 1.497 0 CA-C-N 113.01 -1.904 . . . . 0.0 111.165 -174.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 35.9 t -79.49 113.69 17.83 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 104.482 -2.414 . . . . 0.0 104.482 171.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -100.1 112.8 25.11 Favored 'General case' 0 CA--C 1.567 1.626 0 CA-C-O 123.179 1.466 . . . . 0.0 114.656 -170.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.612 ' HB2' HG12 ' A' ' 57' ' ' VAL . 0.9 OUTLIER -82.46 144.66 30.3 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 126.118 1.767 . . . . 0.0 110.9 176.023 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -82.9 75.55 9.79 Favored 'General case' 0 CA--C 1.58 2.118 0 O-C-N 120.452 -1.405 . . . . 0.0 108.186 171.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.415 HG23 ' H ' ' A' ' 33' ' ' ILE 0.406 11.8 t 55.04 -106.63 0.34 Allowed 'General case' 0 N--CA 1.5 2.034 0 C-N-CA 126.275 1.83 . . . . 0.0 113.207 -173.293 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.415 ' H ' HG23 ' A' ' 32' ' ' THR . 0.2 OUTLIER -103.22 -18.11 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.291 0 CA-C-N 120.68 1.582 . . . . 0.0 114.042 174.256 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.1 tp -72.74 121.74 20.35 Favored 'General case' 0 CA--C 1.569 1.707 0 CA-C-N 121.24 1.836 . . . . 0.0 108.838 173.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 82.1 p -83.86 100.49 11.01 Favored 'General case' 0 CA--C 1.568 1.654 0 N-CA-C 118.823 2.897 . . . . 0.0 118.823 -171.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 38.9 tp -149.23 87.29 1.52 Allowed 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 102.63 -3.1 . . . . 0.0 102.63 171.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 m -100.3 122.16 42.64 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 -171.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -133.49 137.27 45.57 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 124.679 1.192 . . . . 0.0 109.163 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 63.4 m -66.04 142.65 57.74 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 119.501 -1.999 . . . . 0.0 113.28 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -137.69 -172.95 3.36 Favored 'General case' 0 CA--C 1.569 1.691 0 CA-C-N 113.433 -1.712 . . . . 0.0 112.754 -174.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 37.8 tp -90.9 150.8 21.37 Favored 'General case' 0 CA--C 1.573 1.836 0 CA-C-O 122.264 1.031 . . . . 0.0 112.457 176.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -70.38 155.31 40.86 Favored 'General case' 0 CA--C 1.574 1.866 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 173.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.46 150.63 36.67 Favored 'General case' 0 CA--C 1.571 1.762 0 CA-C-O 124.561 2.124 . . . . 0.0 114.043 -174.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -124.61 168.17 13.5 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.186 -1.824 . . . . 0.0 110.857 -175.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -54.41 133.98 45.61 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.907 -1.121 . . . . 0.0 112.616 -176.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.391 8.8 p30 67.77 17.41 9.77 Favored 'General case' 0 CA--C 1.585 2.326 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -171.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.1 t -118.14 153.3 34.03 Favored 'General case' 0 CA--C 1.567 1.607 0 O-C-N 120.78 -1.2 . . . . 0.0 110.253 173.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -60.01 122.67 14.9 Favored 'General case' 0 CA--C 1.572 1.802 0 N-CA-C 117.448 2.388 . . . . 0.0 117.448 -174.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.566 ' HB2' ' SG ' ' A' ' 87' ' ' CYS . 53.2 t -142.81 132.52 23.93 Favored 'General case' 0 CA--C 1.56 1.352 0 CA-C-N 113.816 -1.538 . . . . 0.0 110.848 173.226 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 27.9 t -139.69 158.74 43.6 Favored 'General case' 0 CA--C 1.568 1.666 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 172.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -119.13 126.36 51.42 Favored 'General case' 0 CA--C 1.571 1.751 0 CA-C-O 124.599 2.142 . . . . 0.0 112.169 -173.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 19.8 p90 -146.47 -142.16 0.12 Allowed 'General case' 0 CA--C 1.579 2.095 0 CA-C-N 111.942 -2.39 . . . . 0.0 108.324 -172.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.0 m -63.95 111.33 2.45 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 119.537 -1.977 . . . . 0.0 109.336 171.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.458 2.3 mt -112.1 42.16 1.82 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 117.83 2.53 . . . . 0.0 117.83 -178.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . 0.362 0.5 OUTLIER -153.7 29.87 0.47 Allowed 'General case' 0 CA--C 1.583 2.246 0 CA-C-N 113.353 -1.749 . . . . 0.0 112.141 166.541 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -123.18 -131.86 3.88 Favored Glycine 0 CA--C 1.548 2.155 0 N-CA-C 108.722 -1.751 . . . . 0.0 108.722 172.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.612 HG12 ' HB2' ' A' ' 30' ' ' HIS . 14.2 t -101.84 144.09 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.503 0 O-C-N 121.169 -1.195 . . . . 0.0 108.795 170.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 15.3 m-30 -114.21 136.9 52.44 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 -169.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.36 -48.6 55.59 Favored 'General case' 0 CA--C 1.578 2.048 0 O-C-N 120.886 -1.134 . . . . 0.0 112.723 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.407 ' H ' ' HE2' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -137.12 113.6 10.14 Favored 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 102.155 -3.276 . . . . 0.0 102.155 172.771 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 60.8 m -54.4 148.55 23.74 Favored Pre-proline 0 CA--C 1.587 2.387 0 N-CA-C 115.008 1.485 . . . . 0.0 115.008 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -64.74 169.06 12.12 Favored 'Trans proline' 0 CA--C 1.568 2.206 0 C-N-CA 122.384 2.056 . . . . 0.0 116.602 -173.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 83.8 m -67.72 154.03 42.41 Favored 'General case' 0 CA--C 1.572 1.824 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 -178.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.86 173.99 2.07 Favored 'General case' 0 CA--C 1.579 2.081 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -62.65 108.1 1.09 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.551 -1.343 . . . . 0.0 112.363 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 112.1 -22.51 18.21 Favored Glycine 0 N--CA 1.497 2.743 0 N-CA-C 117.749 1.859 . . . . 0.0 117.749 -173.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.9 mp -98.9 152.21 20.01 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-N 119.064 1.432 . . . . 0.0 112.531 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.3 159.49 15.21 Favored 'General case' 0 CA--C 1.564 1.487 0 CA-C-O 122.508 1.147 . . . . 0.0 112.556 177.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 4.9 t -89.44 96.54 10.75 Favored 'General case' 0 CA--C 1.573 1.845 0 N-CA-C 105.95 -1.87 . . . . 0.0 105.95 172.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -96.7 123.05 40.27 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.69 -1.256 . . . . 0.0 114.374 -171.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 79.42 61.27 2.35 Favored Glycine 0 N--CA 1.495 2.608 0 N-CA-C 115.382 0.913 . . . . 0.0 115.382 -176.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -83.03 83.4 7.85 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.865 0.84 . . . . 0.0 112.707 -167.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -95.53 12.44 29.51 Favored 'General case' 0 CA--C 1.575 1.906 0 N-CA-C 117.059 2.244 . . . . 0.0 117.059 -174.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 88.7 p -76.32 83.69 3.09 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-N 121.412 1.915 . . . . 0.0 111.659 -176.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.4 mt -78.24 74.76 4.78 Favored 'General case' 0 CA--C 1.566 1.596 0 CA-C-O 123.478 1.609 . . . . 0.0 114.134 -173.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 12.9 p -58.95 -36.74 63.32 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 174.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -121.26 53.76 0.69 Allowed Glycine 0 N--CA 1.493 2.444 0 N-CA-C 115.553 0.981 . . . . 0.0 115.553 174.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.1 t -155.37 -59.92 0.11 Allowed 'General case' 0 N--CA 1.498 1.956 0 CA-C-N 118.619 1.21 . . . . 0.0 113.684 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.295 0.2 OUTLIER -136.07 -78.99 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.492 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 5.9 p -140.35 142.98 35.52 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 123.394 1.568 . . . . 0.0 112.659 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -65.92 -20.7 66.3 Favored 'General case' 0 CA--C 1.579 2.095 0 N-CA-C 115.653 1.723 . . . . 0.0 115.653 172.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 80.7 p -96.1 69.86 2.78 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-O 125.313 2.482 . . . . 0.0 113.213 -173.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 26.3 m120 -151.96 100.7 2.67 Favored 'General case' 0 CA--C 1.56 1.359 0 CA-C-N 110.65 -2.977 . . . . 0.0 103.381 -178.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.7 m-30 -118.67 154.27 32.99 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.209 -1.557 . . . . 0.0 115.187 -172.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -94.25 -162.75 35.54 Favored Glycine 0 N--CA 1.488 2.15 0 CA-C-N 115.083 -0.962 . . . . 0.0 113.752 173.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.1 mm -135.53 142.74 38.65 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.009 0 O-C-N 121.761 -0.846 . . . . 0.0 110.537 -176.319 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.566 ' SG ' ' HB2' ' A' ' 49' ' ' CYS . 19.3 m -70.79 130.31 41.36 Favored 'General case' 0 CA--C 1.569 1.709 0 O-C-N 120.169 -1.582 . . . . 0.0 113.375 173.059 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -143.33 155.07 44.35 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 123.228 1.49 . . . . 0.0 112.439 175.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -97.95 73.99 2.29 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 122.794 1.283 . . . . 0.0 111.617 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.7 p -78.86 -54.08 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.7 -74.09 1.59 Allowed Glycine 0 N--CA 1.491 2.337 0 O-C-N 121.256 -0.902 . . . . 0.0 114.963 -176.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 47.6 tpt85 -90.24 85.48 6.25 Favored 'General case' 0 CA--C 1.57 1.713 0 CA-C-O 122.251 1.024 . . . . 0.0 110.984 175.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.7 t . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 124.026 1.869 . . . . 0.0 113.489 -178.266 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.257 79.8 t . . . . . 0 CA--C 1.58 2.12 0 CA-C-O 116.077 -1.916 . . . . 0.0 108.793 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -74.12 169.82 21.56 Favored 'Trans proline' 0 CA--C 1.572 2.393 0 CA-C-N 125.388 2.96 . . . . 0.0 114.9 174.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -108.72 83.93 2.3 Favored Pre-proline 0 CA--C 1.583 2.239 0 CA-C-O 117.638 -1.172 . . . . 0.0 111.547 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -85.7 79.95 2.01 Favored 'Trans proline' 0 CA--C 1.573 2.441 0 C-N-CA 122.678 2.252 . . . . 0.0 115.574 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -99.58 49.01 0.94 Allowed 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 177.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -71.38 -6.49 61.87 Favored Glycine 0 N--CA 1.501 3.026 0 N-CA-C 121.604 3.402 . . . . 0.0 121.604 -177.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 9.2 tp -68.3 -28.03 39.13 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.213 0 N-CA-C 115.598 1.703 . . . . 0.0 115.598 167.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 41.4 mm -102.34 -59.84 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 CA-C-N 119.47 1.032 . . . . 0.0 110.53 176.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.6 pt -98.45 139.92 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 CA-C-O 122.89 1.329 . . . . 0.0 112.159 -174.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -148.21 98.13 2.87 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 -173.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.4 tp -150.23 115.33 5.38 Favored 'General case' 0 CA--C 1.577 1.998 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 173.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -75.55 162.31 28.4 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 115.845 1.795 . . . . 0.0 115.845 -172.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.91 140.86 56.38 Favored 'General case' 0 CA--C 1.574 1.869 0 CA-C-O 122.481 1.134 . . . . 0.0 113.809 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.91 2.35 61.12 Favored Glycine 0 N--CA 1.496 2.659 0 N-CA-C 117.856 1.902 . . . . 0.0 117.856 -174.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -112.42 133.04 54.72 Favored 'General case' 0 CA--C 1.566 1.565 0 CA-C-N 118.935 1.367 . . . . 0.0 110.082 -175.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.9 tt -68.33 119.86 13.52 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.424 -0.797 . . . . 0.0 111.834 -176.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 24.7 p -128.07 158.42 38.01 Favored 'General case' 0 CA--C 1.558 1.268 0 CA-C-O 122.35 1.072 . . . . 0.0 112.798 -175.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.8 mt -92.98 -73.67 0.55 Allowed 'General case' 0 CA--C 1.568 1.664 0 O-C-N 120.835 -1.166 . . . . 0.0 108.61 173.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -91.94 150.75 20.85 Favored 'General case' 0 CA--C 1.569 1.674 0 N-CA-C 115.822 1.786 . . . . 0.0 115.822 178.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.1 m -68.56 -16.51 63.89 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 124.93 1.292 . . . . 0.0 114.162 170.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . 0.325 . . -75.03 28.64 0.09 Allowed 'General case' 0 CA--C 1.594 2.645 0 C-N-CA 126.608 1.963 . . . . 0.0 114.036 171.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -138.52 -39.52 0.52 Allowed 'General case' 0 CA--C 1.583 2.217 0 C-N-CA 127.731 2.413 . . . . 0.0 113.126 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.9 m -65.18 -171.67 0.08 Allowed 'General case' 0 CA--C 1.587 2.388 0 CA-C-N 121.817 2.099 . . . . 0.0 115.201 -177.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -70.12 -57.63 4.73 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 119.101 -2.249 . . . . 0.0 115.225 -175.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 36.3 m -82.37 -78.87 0.19 Allowed 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 173.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -174.49 68.95 0.03 OUTLIER 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 173.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.3 t -151.87 94.24 1.95 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 118.885 -2.385 . . . . 0.0 116.553 -174.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 26.3 t -95.63 112.61 24.29 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 101.283 -3.599 . . . . 0.0 101.283 168.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -91.7 124.06 35.56 Favored 'General case' 0 CA--C 1.562 1.421 0 CA-C-O 122.548 1.166 . . . . 0.0 113.786 -171.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.431 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.7 t60 -79.27 131.96 36.32 Favored 'General case' 0 CA--C 1.56 1.361 0 C-N-CA 125.098 1.359 . . . . 0.0 112.031 -174.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.83 31.29 0.09 Allowed 'General case' 0 CA--C 1.585 2.293 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.253 24.9 p 70.31 100.69 0.06 Allowed 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 126.47 1.908 . . . . 0.0 112.096 179.101 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.29 3.7 mp 72.83 -63.66 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 C-N-CA 125.477 1.511 . . . . 0.0 111.614 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.7 tp -68.26 128.89 38.21 Favored 'General case' 0 CA--C 1.571 1.755 0 CA-C-N 120.624 1.556 . . . . 0.0 110.776 174.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.9 p -86.65 31.5 0.68 Allowed 'General case' 0 CA--C 1.571 1.782 0 N-CA-C 118.954 2.946 . . . . 0.0 118.954 -173.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 31.3 tp -82.42 93.61 7.25 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 172.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.1 m -97.35 148.93 22.66 Favored 'General case' 0 CA--C 1.566 1.56 0 CA-C-O 123.325 1.536 . . . . 0.0 114.022 -170.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 57.2 ttm-85 -141.2 137.2 32.47 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.197 -0.939 . . . . 0.0 109.676 -176.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 58.7 m -61.07 140.09 57.94 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 119.632 -1.917 . . . . 0.0 111.896 175.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.69 178.12 7.46 Favored 'General case' 0 CA--C 1.565 1.548 0 N-CA-C 116.492 2.034 . . . . 0.0 116.492 -172.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.8 tp -86.77 149.6 24.75 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-O 122.26 1.029 . . . . 0.0 112.248 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -67.12 141.1 57.54 Favored 'General case' 0 CA--C 1.572 1.793 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 174.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.412 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . . . -75.73 162.12 28.48 Favored 'General case' 0 CA--C 1.571 1.774 0 CA-C-O 124.181 1.943 . . . . 0.0 115.173 -176.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -111.09 -178.81 3.56 Favored 'General case' 0 CA--C 1.567 1.61 0 CA-C-N 113.397 -1.729 . . . . 0.0 113.082 -173.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -60.0 135.34 57.68 Favored 'General case' 0 CA--C 1.568 1.648 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -176.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 66.72 38.14 4.0 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 124.902 1.281 . . . . 0.0 113.307 -173.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 10.9 t -128.19 140.36 51.95 Favored 'General case' 0 CA--C 1.561 1.391 0 O-C-N 121.011 -1.055 . . . . 0.0 111.991 178.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -73.06 97.05 2.27 Favored 'General case' 0 CA--C 1.572 1.793 0 C-N-CA 124.13 0.972 . . . . 0.0 112.226 178.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.16 136.48 36.57 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-O 122.117 0.961 . . . . 0.0 112.057 177.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 91.8 p -88.06 116.12 26.02 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 105.226 -2.139 . . . . 0.0 105.226 171.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -80.02 -117.9 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.964 0 CA-C-O 116.219 -1.848 . . . . 0.0 114.583 -172.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -130.42 154.0 48.18 Favored 'General case' 0 CA--C 1.567 1.6 1 N-CA-C 123.486 4.625 . . . . 0.0 123.486 -170.165 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.434 24.0 p 43.29 122.15 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.258 0 CA-C-N 108.4 -4.0 . . . . 0.0 116.378 -172.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.775 HD23 ' H ' ' A' ' 56' ' ' GLY 0.418 0.0 OUTLIER -145.54 -71.55 0.26 Allowed 'General case' 0 CA--C 1.576 1.946 1 CA-C-N 107.695 -4.32 . . . . 0.0 102.142 -173.309 . . . . . . . . 5 4 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.626 ' H ' HD23 ' A' ' 54' ' ' LEU . 52.6 t80 -158.99 -30.77 0.07 Allowed 'General case' 0 CA--C 1.591 2.55 0 C-N-CA 127.694 2.398 . . . . 0.0 110.474 171.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.775 ' H ' HD23 ' A' ' 54' ' ' LEU . . . 122.93 43.82 0.35 Allowed Glycine 0 CA--C 1.556 2.605 0 N-CA-C 117.436 1.735 . . . . 0.0 117.436 -172.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.431 HG12 ' HB2' ' A' ' 30' ' ' HIS . 11.3 t -138.84 132.68 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.422 0 CA-C-N 122.958 3.379 . . . . 0.0 106.428 145.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -117.84 132.11 56.48 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.744 -172.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -61.97 -42.62 99.33 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 120.038 -1.663 . . . . 0.0 115.402 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -142.76 119.27 11.0 Favored 'General case' 0 CA--C 1.562 1.408 0 N-CA-C 105.277 -2.12 . . . . 0.0 105.277 174.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 84.2 m -44.17 148.95 0.75 Allowed Pre-proline 0 CA--C 1.593 2.607 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 -176.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -70.05 42.23 0.36 Allowed 'Trans proline' 0 CA--C 1.574 2.519 1 N-CA-C 122.521 4.008 . . . . 0.0 122.521 -171.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.412 ' SG ' ' HB3' ' A' ' 43' ' ' ALA . 67.6 m 58.98 154.13 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 117.516 2.413 . . . . 0.0 117.516 175.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -62.27 151.83 35.31 Favored 'General case' 0 CA--C 1.573 1.837 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -179.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -68.98 104.08 2.0 Favored 'General case' 0 CA--C 1.573 1.84 0 CA-C-O 122.38 1.086 . . . . 0.0 112.324 -174.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 136.44 -29.49 2.79 Favored Glycine 0 N--CA 1.497 2.742 0 N-CA-C 116.108 1.203 . . . . 0.0 116.108 -173.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.5 mp -96.88 144.6 26.67 Favored 'General case' 0 CA--C 1.566 1.567 0 C-N-CA 124.372 1.069 . . . . 0.0 111.538 177.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -99.43 135.77 40.36 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 122.012 0.911 . . . . 0.0 111.567 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 30.3 t -94.99 113.89 25.64 Favored 'General case' 0 CA--C 1.568 1.641 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.669 175.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -92.94 81.16 4.6 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.122 -1.611 . . . . 0.0 113.319 -174.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -34.95 85.11 0.01 OUTLIER Glycine 0 N--CA 1.503 3.15 0 N-CA-C 121.829 3.492 . . . . 0.0 121.829 -177.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -83.36 68.43 9.69 Favored 'General case' 0 CA--C 1.577 2.003 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 -169.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 66.8 mttm 66.69 -56.98 0.4 Allowed 'General case' 0 N--CA 1.509 2.489 0 N-CA-C 118.211 2.671 . . . . 0.0 118.211 174.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . 0.289 66.1 m 74.44 -40.48 0.45 Allowed 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -178.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -17.77 62.07 Favored 'General case' 0 CA--C 1.58 2.113 0 N-CA-C 116.222 1.934 . . . . 0.0 116.222 173.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.8 p -82.46 74.12 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.578 2.027 0 CA-C-O 123.682 1.705 . . . . 0.0 112.474 178.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -154.5 85.19 0.14 Allowed Glycine 0 N--CA 1.487 2.034 0 CA-C-N 115.091 -0.959 . . . . 0.0 112.421 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 30.0 t -77.03 42.05 0.31 Allowed 'General case' 0 CA--C 1.583 2.226 0 N-CA-C 117.604 2.446 . . . . 0.0 117.604 -175.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.464 HG23 ' H ' ' A' ' 80' ' ' THR . 17.9 tt -160.02 -74.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 174.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.464 ' H ' HG23 ' A' ' 79' ' ' ILE . 3.3 p -125.44 139.76 53.36 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 122.898 1.333 . . . . 0.0 109.94 173.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -82.24 53.23 2.2 Favored 'General case' 0 CA--C 1.574 1.899 0 N-CA-C 115.521 1.674 . . . . 0.0 115.521 -177.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 40.3 p -103.45 71.35 1.09 Allowed 'General case' 0 N--CA 1.502 2.133 0 CA-C-O 124.966 2.317 . . . . 0.0 109.667 174.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -135.11 95.58 3.33 Favored 'General case' 0 CA--C 1.564 1.498 0 CA-C-N 111.521 -2.581 . . . . 0.0 108.057 -174.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -131.51 -178.34 4.81 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 120.651 -1.281 . . . . 0.0 112.49 -174.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -73.6 135.61 20.9 Favored Glycine 0 N--CA 1.487 2.048 0 N-CA-C 116.645 1.418 . . . . 0.0 116.645 -179.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.6 mm -89.76 134.15 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 CA-C-O 122.743 1.259 . . . . 0.0 109.047 -174.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 69.6 m -80.81 122.42 27.16 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -132.79 153.02 51.65 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 122.733 1.254 . . . . 0.0 110.701 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -93.61 127.14 39.14 Favored 'General case' 0 CA--C 1.56 1.36 0 CA-C-O 122.834 1.302 . . . . 0.0 110.617 -174.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.4 p -141.39 -50.03 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-N 114.124 -1.398 . . . . 0.0 113.422 -173.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 70.49 71.97 0.95 Allowed Glycine 0 N--CA 1.494 2.518 0 N-CA-C 116.397 1.319 . . . . 0.0 116.397 176.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 86.7 mtm180 71.95 -65.79 0.33 Allowed 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 124.499 1.12 . . . . 0.0 112.539 -173.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.1 m . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 125.13 2.395 . . . . 0.0 108.138 174.599 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 41.9 t . . . . . 0 CA--C 1.579 2.059 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -60.19 99.08 0.13 Allowed 'Trans proline' 0 CA--C 1.57 2.287 0 C-N-CA 123.038 2.492 . . . . 0.0 116.959 -178.933 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -112.24 96.13 33.73 Favored Pre-proline 0 CA--C 1.576 1.957 0 CA-C-O 118.162 -0.923 . . . . 0.0 109.92 -179.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -80.88 71.84 6.84 Favored 'Trans proline' 0 CA--C 1.57 2.29 0 C-N-CA 122.419 2.079 . . . . 0.0 114.935 -178.855 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 76.3 mtp180 -80.48 -59.27 2.76 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -176.885 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -125.11 62.2 0.59 Allowed Glycine 0 N--CA 1.495 2.623 0 O-C-N 121.428 -0.795 . . . . 0.0 115.038 174.686 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 28.8 mt -121.04 -55.17 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 C-N-CA 123.484 0.714 . . . . 0.0 110.305 -177.483 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.4 mp 61.65 66.87 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 C-N-CA 125.083 1.353 . . . . 0.0 112.706 176.412 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 36.8 pt -134.42 171.3 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 120.995 -1.066 . . . . 0.0 111.999 -178.816 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . 0.253 69.3 m-80 97.6 89.16 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 127.339 2.255 . . . . 0.0 111.308 -179.682 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.4 ' H ' ' HA ' ' A' ' 23' ' ' CYS . 1.7 pt? -141.75 164.3 30.56 Favored 'General case' 0 CA--C 1.577 2.011 0 CA-C-O 122.519 1.152 . . . . 0.0 111.491 173.746 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -80.14 167.34 20.48 Favored 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 116.291 1.96 . . . . 0.0 116.291 -173.231 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -72.03 138.91 48.25 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.433 0.693 . . . . 0.0 110.418 175.005 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 92.83 5.84 64.14 Favored Glycine 0 CA--C 1.558 2.766 0 N-CA-C 116.23 1.252 . . . . 0.0 116.23 -172.149 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -109.09 144.38 37.2 Favored 'General case' 0 CA--C 1.567 1.611 0 CA-C-N 119.002 1.401 . . . . 0.0 109.925 174.475 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 tt -67.4 115.45 7.06 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -174.744 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.5 p -110.91 152.82 26.3 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 124.359 1.063 . . . . 0.0 113.264 179.411 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.3 mt -84.54 -78.69 0.24 Allowed 'General case' 0 CA--C 1.568 1.657 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 174.127 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -96.09 177.85 5.6 Favored 'General case' 0 CA--C 1.578 2.052 0 O-C-N 121.202 -0.936 . . . . 0.0 113.191 172.795 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.1 m -77.37 -19.37 56.32 Favored 'General case' 0 N--CA 1.504 2.25 0 N-CA-C 116.48 2.03 . . . . 0.0 116.48 174.894 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.32 17.71 0.47 Allowed 'General case' 0 CA--C 1.581 2.164 0 N-CA-C 116.655 2.095 . . . . 0.0 116.655 173.939 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -96.9 -48.87 5.26 Favored 'General case' 0 CA--C 1.57 1.723 0 C-N-CA 125.127 1.371 . . . . 0.0 114.1 -177.194 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.4 ' HA ' ' H ' ' A' ' 11' ' ' LEU . 87.9 m -81.19 170.63 15.89 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 115.965 1.839 . . . . 0.0 115.965 -177.4 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -63.06 -55.83 22.15 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 123.561 0.745 . . . . 0.0 109.283 171.531 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.4 t -82.56 100.4 10.1 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 104.166 -2.531 . . . . 0.0 104.166 169.077 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -72.67 71.86 1.01 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 125.081 2.372 . . . . 0.0 114.39 -173.642 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.411 ' SG ' ' HB3' ' A' ' 40' ' ' ALA . 2.1 t -148.02 86.19 1.56 Allowed 'General case' 0 CA--C 1.559 1.316 0 CA-C-N 112.373 -2.194 . . . . 0.0 109.513 -173.531 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.7 t -80.66 119.5 23.37 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 120.586 -1.321 . . . . 0.0 107.908 173.857 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.9 tp60 -101.42 117.51 35.08 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.542 1.137 . . . . 0.0 113.22 -172.96 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 8.4 m170 -60.73 159.59 10.69 Favored 'General case' 0 CA--C 1.567 1.603 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 177.162 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -89.91 60.37 4.92 Favored 'General case' 0 CA--C 1.578 2.04 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 171.126 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.7 m 80.96 -75.3 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.191 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 -169.06 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.0 mt -138.2 -115.25 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.584 2.253 0 N-CA-C 103.502 -2.777 . . . . 0.0 103.502 172.535 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.251 3.8 mm? 41.59 -107.89 0.09 Allowed 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 127.123 2.169 . . . . 0.0 114.806 174.56 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 89.8 p -152.1 -111.3 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.315 0 CA-C-O 116.133 -1.889 . . . . 0.0 109.709 173.27 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.0 tp 23.24 60.97 0.04 OUTLIER 'General case' 0 N--CA 1.514 2.761 0 CA-C-N 121.362 1.892 . . . . 0.0 115.683 -174.35 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 45.2 m -99.17 119.15 37.39 Favored 'General case' 0 CA--C 1.554 1.098 0 CA-C-N 114.257 -1.338 . . . . 0.0 112.298 -170.664 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -99.11 165.65 11.62 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.961 -0.462 . . . . 0.0 110.469 175.083 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 45.9 m -80.59 152.16 28.71 Favored 'General case' 0 CA--C 1.563 1.475 0 O-C-N 119.064 -2.272 . . . . 0.0 112.12 173.447 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.411 ' HB3' ' SG ' ' A' ' 27' ' ' CYS . . . -140.66 -178.76 5.67 Favored 'General case' 0 CA--C 1.569 1.675 0 CA-C-N 113.282 -1.781 . . . . 0.0 112.689 -173.915 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -88.42 137.32 32.43 Favored 'General case' 0 CA--C 1.568 1.642 0 O-C-N 121.01 -1.056 . . . . 0.0 112.571 179.629 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.97 155.42 30.8 Favored 'General case' 0 CA--C 1.576 1.979 0 CA-C-O 121.868 0.842 . . . . 0.0 110.709 172.422 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.53 156.43 27.77 Favored 'General case' 0 CA--C 1.568 1.642 0 N-CA-C 116.735 2.124 . . . . 0.0 116.735 -173.634 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 22.7 mtm180 -129.29 172.93 10.99 Favored 'General case' 0 CA--C 1.563 1.47 0 CA-C-N 112.806 -1.997 . . . . 0.0 109.761 177.558 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -48.77 130.45 17.73 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 115.62 1.711 . . . . 0.0 115.62 -173.891 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.8 m120 77.19 10.24 2.52 Favored 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 -174.182 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 30.7 t -109.26 148.75 30.48 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 120.532 1.514 . . . . 0.0 112.268 175.277 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -79.76 112.56 17.16 Favored 'General case' 0 CA--C 1.57 1.744 0 CA-C-O 123.839 1.781 . . . . 0.0 112.747 -178.346 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.97 177.4 5.44 Favored 'General case' 0 CA--C 1.571 1.772 0 CA-C-N 112.304 -2.225 . . . . 0.0 111.048 173.639 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.432 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 58.3 m -79.65 -113.03 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 104.872 -2.27 . . . . 0.0 104.872 170.017 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -160.17 -80.53 0.05 OUTLIER 'General case' 0 CA--C 1.564 1.486 0 CA-C-N 122.862 2.573 . . . . 0.0 110.788 172.272 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -77.63 -46.34 22.36 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 174.743 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.9 p 60.74 153.62 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 124.954 2.312 . . . . 0.0 116.447 -176.858 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.53 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.6 pt? -97.59 179.45 4.84 Favored 'General case' 0 CA--C 1.583 2.234 0 CA-C-N 112.71 -2.041 . . . . 0.0 108.685 171.985 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -84.76 12.84 6.54 Favored 'General case' 0 N--CA 1.514 2.743 0 O-C-N 118.422 -2.674 . . . . 0.0 114.036 174.009 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.45 ' H ' ' HG ' ' A' ' 54' ' ' LEU . . . -113.41 -152.42 11.0 Favored Glycine 0 N--CA 1.476 1.357 0 O-C-N 120.99 -1.069 . . . . 0.0 114.226 -173.831 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.5 t -78.49 142.08 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 CA-C-O 122.912 1.339 . . . . 0.0 111.314 -167.442 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -119.51 153.61 35.09 Favored 'General case' 0 CA--C 1.561 1.393 0 N-CA-C 116.468 2.025 . . . . 0.0 116.468 -171.329 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -83.03 -56.08 4.0 Favored 'General case' 0 CA--C 1.577 2.016 0 CA-C-N 113.253 -1.794 . . . . 0.0 110.077 172.964 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -133.16 108.01 8.54 Favored 'General case' 0 CA--C 1.564 1.505 0 N-CA-C 104.606 -2.368 . . . . 0.0 104.606 173.448 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.6 m -52.11 153.06 5.08 Favored Pre-proline 0 CA--C 1.584 2.259 0 N-CA-C 118.433 2.753 . . . . 0.0 118.433 -175.333 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -70.31 172.29 13.45 Favored 'Trans proline' 0 CA--C 1.568 2.204 0 C-N-CA 122.687 2.258 . . . . 0.0 115.574 -177.904 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 60.4 m -70.77 156.39 39.58 Favored 'General case' 0 CA--C 1.571 1.754 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 177.312 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.53 168.55 3.56 Favored 'General case' 0 CA--C 1.58 2.099 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 174.793 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 91.5 mtt180 -63.03 112.16 2.48 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.227 -1.546 . . . . 0.0 113.492 -175.52 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 114.42 -22.83 13.0 Favored Glycine 0 N--CA 1.495 2.622 0 N-CA-C 118.926 2.33 . . . . 0.0 118.926 -173.984 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.7 mp -99.43 143.76 29.31 Favored 'General case' 0 CA--C 1.572 1.792 0 CA-C-N 119.462 1.631 . . . . 0.0 112.877 -176.02 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -102.23 155.44 18.22 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 124.116 0.967 . . . . 0.0 113.413 -177.308 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.432 ' SG ' ' O ' ' A' ' 50' ' ' SER . 1.9 t -94.67 83.71 4.12 Favored 'General case' 0 CA--C 1.579 2.079 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 179.684 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -131.2 121.59 25.1 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.476 -1.39 . . . . 0.0 112.034 -176.703 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 157.02 -68.18 0.29 Allowed Glycine 0 N--CA 1.496 2.661 0 O-C-N 120.528 -1.357 . . . . 0.0 114.258 175.52 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -80.91 169.06 18.02 Favored 'General case' 0 CA--C 1.577 1.99 0 CA-C-O 121.858 0.837 . . . . 0.0 111.525 166.937 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.47 106.17 1.3 Allowed 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 106.382 -1.71 . . . . 0.0 106.382 -179.583 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.3 m -93.83 83.48 4.4 Favored 'General case' 0 CA--C 1.56 1.333 0 CA-C-O 122.446 1.117 . . . . 0.0 113.679 -173.541 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.9 mp -87.22 61.96 7.0 Favored 'General case' 0 CA--C 1.58 2.115 0 CA-C-O 122.041 0.924 . . . . 0.0 111.607 175.747 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 55.5 t -136.53 93.66 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 -176.264 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.96 66.24 3.62 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 115.998 1.159 . . . . 0.0 115.998 175.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 36.0 t -128.3 -123.93 0.23 Allowed 'General case' 0 CA--C 1.574 1.88 0 C-N-CA 123.736 0.814 . . . . 0.0 110.333 179.449 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.4 pt -87.68 -64.8 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.143 0 O-C-N 120.3 -1.5 . . . . 0.0 112.26 179.568 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 29.8 p -114.12 -178.66 3.43 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 119.655 1.116 . . . . 0.0 110.665 174.461 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 37.6 t30 64.64 67.53 0.55 Allowed 'General case' 0 N--CA 1.503 2.213 0 O-C-N 120.857 -1.152 . . . . 0.0 107.999 -172.737 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 36.4 p -98.64 -57.37 2.2 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 -169.925 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -157.63 81.88 0.89 Allowed 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 175.726 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.9 m-30 -112.53 161.33 16.88 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 -173.792 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -160.55 167.31 35.69 Favored Glycine 0 CA--C 1.556 2.61 0 C-N-CA 124.895 1.236 . . . . 0.0 112.866 -179.573 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.5 mm -98.35 134.14 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.519 0 O-C-N 119.582 -2.128 . . . . 0.0 110.436 -179.388 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 94.9 m -63.21 123.83 19.64 Favored 'General case' 0 CA--C 1.572 1.792 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 174.662 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 79.0 m-70 -144.33 155.48 43.83 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-O 122.553 1.168 . . . . 0.0 111.613 175.57 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 40.0 t-20 -96.71 122.92 40.18 Favored 'General case' 0 CA--C 1.566 1.594 0 O-C-N 120.892 -1.13 . . . . 0.0 110.354 179.433 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.5 t -134.74 86.45 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 -174.964 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 84.15 -61.17 4.76 Favored Glycine 0 N--CA 1.496 2.662 0 N-CA-C 117.272 1.669 . . . . 0.0 117.272 -178.653 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? 72.98 92.68 0.08 Allowed 'General case' 0 N--CA 1.497 1.894 0 C-N-CA 125.332 1.453 . . . . 0.0 112.413 179.08 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 83.2 p . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 124.265 1.983 . . . . 0.0 112.873 177.55 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 23.3 m . . . . . 0 CA--C 1.579 2.085 0 CA-C-O 118.967 -0.539 . . . . 0.0 112.15 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -64.9 -28.22 58.59 Favored 'Trans proline' 0 CA--C 1.573 2.449 0 N-CA-C 117.547 2.095 . . . . 0.0 117.547 175.837 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -110.79 82.6 3.07 Favored Pre-proline 0 CA--C 1.581 2.145 0 C-N-CA 124.272 1.029 . . . . 0.0 110.624 174.643 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.85 92.43 1.04 Allowed 'Trans proline' 0 CA--C 1.569 2.239 0 C-N-CA 122.644 2.229 . . . . 0.0 114.341 -177.491 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.469 ' H ' ' HD3' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -83.5 56.7 3.7 Favored 'General case' 0 CA--C 1.577 2.018 0 N-CA-C 114.776 1.398 . . . . 0.0 114.776 -178.494 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.35 78.77 0.08 OUTLIER Glycine 0 N--CA 1.489 2.196 0 O-C-N 120.901 -1.124 . . . . 0.0 113.737 -178.952 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 11.0 tp -71.48 -31.69 43.74 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.011 0 N-CA-C 117.541 2.422 . . . . 0.0 117.541 -174.041 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.255 41.0 mt 75.87 -49.85 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.658 0 CA-C-N 120.307 1.412 . . . . 0.0 113.542 177.599 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.431 HG13 ' H ' ' A' ' 10' ' ' ASN . 16.7 pt -96.93 -94.01 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 CA-C-N 120.346 1.43 . . . . 0.0 111.351 -174.191 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.431 ' H ' HG13 ' A' ' 9' ' ' ILE 0.307 0.0 OUTLIER 49.35 75.07 0.16 Allowed 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 116.656 2.095 . . . . 0.0 116.656 -179.993 . . . . . . . . 4 4 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 tp -132.34 120.49 22.14 Favored 'General case' 0 CA--C 1.569 1.707 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 -174.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -81.78 173.55 12.18 Favored 'General case' 0 CA--C 1.569 1.693 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 -172.659 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -56.37 137.87 51.94 Favored 'General case' 0 CA--C 1.568 1.652 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 176.787 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.8 -17.49 27.6 Favored Glycine 0 N--CA 1.497 2.734 0 N-CA-C 118.122 2.009 . . . . 0.0 118.122 -177.162 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -100.3 145.56 27.99 Favored 'General case' 0 CA--C 1.564 1.503 0 CA-C-N 118.428 1.114 . . . . 0.0 112.216 -177.251 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 72.6 mt -77.9 137.55 38.42 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 122.08 0.943 . . . . 0.0 113.119 -179.634 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.6 p -138.62 149.65 45.44 Favored 'General case' 0 CA--C 1.562 1.417 0 CA-C-O 122.073 0.939 . . . . 0.0 112.827 -174.567 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 98.7 mt -84.38 -74.04 0.4 Allowed 'General case' 0 CA--C 1.567 1.616 0 O-C-N 121.424 -0.797 . . . . 0.0 109.126 174.434 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.8 p30 -95.06 173.58 7.51 Favored 'General case' 0 CA--C 1.577 1.984 0 CA-C-N 120.111 1.323 . . . . 0.0 113.473 172.846 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.8 m -78.69 -19.27 52.86 Favored 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 116.994 2.22 . . . . 0.0 116.994 174.923 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.72 31.62 0.16 Allowed 'General case' 0 CA--C 1.579 2.083 0 N-CA-C 116.685 2.105 . . . . 0.0 116.685 174.342 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -114.72 -34.77 5.05 Favored 'General case' 0 CA--C 1.576 1.977 0 C-N-CA 126.414 1.886 . . . . 0.0 113.003 174.393 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . 0.273 67.3 m -80.67 -133.82 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.909 0 CA-C-N 120.87 1.668 . . . . 0.0 114.533 -174.983 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.3 -77.43 0.19 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 119.238 -2.164 . . . . 0.0 112.378 -173.777 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 77.4 p -88.33 -63.86 1.23 Allowed 'General case' 0 CA--C 1.568 1.653 0 CA-C-O 122.547 1.165 . . . . 0.0 110.481 173.09 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -169.66 81.78 0.12 Allowed 'General case' 0 CA--C 1.568 1.665 0 N-CA-C 103.991 -2.596 . . . . 0.0 103.991 177.416 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 53.5 t -140.85 62.98 1.47 Allowed 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 118.634 2.827 . . . . 0.0 118.634 -171.71 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 22.7 t -93.39 116.68 29.23 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 170.796 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.31 118.42 36.85 Favored 'General case' 0 CA--C 1.57 1.718 0 CA-C-O 122.663 1.221 . . . . 0.0 113.716 -172.367 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.517 ' HB2' HG12 ' A' ' 57' ' ' VAL . 5.6 t-160 -84.13 125.09 31.83 Favored 'General case' 0 CA--C 1.564 1.491 0 C-N-CA 124.921 1.289 . . . . 0.0 111.184 -178.025 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . 0.3 0.3 OUTLIER -83.41 57.64 4.12 Favored 'General case' 0 CA--C 1.58 2.117 0 O-C-N 120.735 -1.228 . . . . 0.0 114.252 175.191 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.351 18.3 p 90.83 178.77 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.756 0 C-N-CA 127.13 2.172 . . . . 0.0 112.354 -174.897 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 14.8 mm -59.86 -62.45 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 119.616 -1.928 . . . . 0.0 115.282 -172.695 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.5 tp -92.62 79.93 4.82 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-N 120.184 1.356 . . . . 0.0 108.863 174.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.3 p -145.96 172.23 13.67 Favored 'General case' 0 CA--C 1.568 1.67 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 -173.194 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 39.9 tp -88.16 140.08 29.85 Favored 'General case' 0 CA--C 1.574 1.865 0 CA-C-O 121.682 0.753 . . . . 0.0 111.507 174.514 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.5 m -104.61 110.92 23.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.951 -1.093 . . . . 0.0 112.063 -175.024 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.5 ttp180 -121.12 142.02 50.26 Favored 'General case' 0 CA--C 1.567 1.629 0 C-N-CA 124.21 1.004 . . . . 0.0 109.758 178.615 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 55.2 m -69.81 150.78 46.49 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-O 124.776 2.227 . . . . 0.0 114.323 179.03 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -132.39 -178.39 4.9 Favored 'General case' 0 CA--C 1.562 1.442 0 CA-C-N 111.774 -2.466 . . . . 0.0 113.111 -174.18 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.1 mt -84.89 138.19 32.68 Favored 'General case' 0 CA--C 1.567 1.597 0 O-C-N 121.242 -0.911 . . . . 0.0 111.742 177.75 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -68.4 139.64 55.8 Favored 'General case' 0 CA--C 1.576 1.945 0 O-C-N 121.56 -0.712 . . . . 0.0 111.065 173.841 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.39 151.31 39.72 Favored 'General case' 0 CA--C 1.57 1.712 0 N-CA-C 118.122 2.638 . . . . 0.0 118.122 -171.359 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 50.5 mtp180 -104.1 168.95 8.78 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 112.809 -1.996 . . . . 0.0 111.866 -178.903 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -52.77 126.68 20.81 Favored 'General case' 0 CA--C 1.573 1.837 0 N-CA-C 114.222 1.194 . . . . 0.0 114.222 -174.915 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 71.66 32.65 1.95 Allowed 'General case' 0 N--CA 1.503 2.214 0 C-N-CA 125.132 1.373 . . . . 0.0 113.599 -172.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.7 m -130.24 153.49 48.55 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.685 -1.26 . . . . 0.0 111.033 174.83 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -69.98 136.1 50.1 Favored 'General case' 0 CA--C 1.574 1.882 0 CA-C-O 124.002 1.858 . . . . 0.0 114.412 -176.177 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.434 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 26.7 p -138.93 148.25 43.32 Favored 'General case' 0 CA--C 1.566 1.593 0 CA-C-N 112.563 -2.108 . . . . 0.0 111.496 -178.372 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.3 m -78.25 107.76 11.09 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.277 -1.514 . . . . 0.0 108.253 174.299 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.34 -40.14 62.36 Favored 'General case' 0 CA--C 1.57 1.718 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -174.618 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -86.36 145.65 26.8 Favored 'General case' 0 CA--C 1.571 1.781 0 C-N-CA 124.344 1.058 . . . . 0.0 109.202 172.278 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.7 p -123.93 145.7 48.96 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-O 123.796 1.76 . . . . 0.0 109.867 173.406 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . 0.264 0.6 OUTLIER -109.1 -135.25 0.35 Allowed 'General case' 0 CA--C 1.565 1.55 0 CA-C-N 113.404 -1.725 . . . . 0.0 106.668 174.551 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -130.95 71.34 1.47 Allowed 'General case' 0 CA--C 1.569 1.69 0 N-CA-C 104.023 -2.584 . . . . 0.0 104.023 170.178 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 169.74 -159.72 32.52 Favored Glycine 0 N--CA 1.486 1.968 0 N-CA-C 117.125 1.61 . . . . 0.0 117.125 -174.177 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.517 HG12 ' HB2' ' A' ' 30' ' ' HIS . 5.2 t -79.19 146.92 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.99 0 CA-C-O 122.343 1.068 . . . . 0.0 112.277 -166.801 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -123.87 158.41 31.95 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -173.153 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -86.16 -21.91 27.3 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 174.373 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -146.37 122.8 11.01 Favored 'General case' 0 CA--C 1.564 1.519 0 N-CA-C 105.507 -2.035 . . . . 0.0 105.507 177.826 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.473 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 56.9 m -58.91 134.05 87.07 Favored Pre-proline 0 CA--C 1.597 2.775 0 O-C-N 119.888 -1.758 . . . . 0.0 115.27 -179.907 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 61' ' ' CYS . 36.5 Cg_exo -66.76 64.77 0.56 Allowed 'Trans proline' 0 CA--C 1.581 2.825 0 N-CA-C 121.307 3.541 . . . . 0.0 121.307 -174.064 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 69.1 m 58.53 164.0 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 175.838 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -79.21 166.27 22.36 Favored 'General case' 0 CA--C 1.576 1.977 0 O-C-N 120.64 -1.287 . . . . 0.0 113.934 174.287 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -63.43 115.29 4.49 Favored 'General case' 0 CA--C 1.573 1.864 0 O-C-N 120.965 -1.085 . . . . 0.0 113.612 -178.05 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 107.31 -17.99 36.46 Favored Glycine 0 N--CA 1.5 2.931 0 N-CA-C 118.311 2.084 . . . . 0.0 118.311 -174.193 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.1 mp -98.04 151.81 19.94 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-N 118.584 1.192 . . . . 0.0 111.638 179.049 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -100.26 149.87 23.14 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.835 -1.166 . . . . 0.0 112.192 175.982 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 11.8 t -92.6 120.03 32.64 Favored 'General case' 0 CA--C 1.567 1.634 0 CA-C-N 115.07 -0.968 . . . . 0.0 108.892 172.924 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -95.0 80.5 3.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.748 -1.22 . . . . 0.0 110.991 -174.031 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -82.86 69.42 3.37 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 118.636 2.214 . . . . 0.0 118.636 -174.211 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -75.92 -44.3 40.93 Favored 'General case' 0 CA--C 1.574 1.9 0 N-CA-C 115.037 1.495 . . . . 0.0 115.037 176.897 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -137.05 111.74 8.75 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 120.04 1.291 . . . . 0.0 109.212 175.861 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.7 t -155.25 -62.23 0.12 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.398 -0.814 . . . . 0.0 111.709 174.715 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 56.19 82.73 0.1 Allowed 'General case' 0 CA--C 1.579 2.082 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 174.184 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . 0.366 2.3 p 57.87 -52.11 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.286 0 N-CA-C 120.266 3.432 . . . . 0.0 120.266 174.582 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.82 29.9 66.7 Favored Glycine 0 N--CA 1.495 2.605 0 N-CA-C 119.523 2.569 . . . . 0.0 119.523 -177.256 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.2 t -69.93 -39.8 75.9 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 116.253 1.945 . . . . 0.0 116.253 -179.883 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 10.4 tp -119.42 68.5 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.212 0 CA-C-O 123.516 1.627 . . . . 0.0 108.095 172.655 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . 0.253 9.7 t 37.09 118.95 0.0 OUTLIER 'General case' 0 CA--C 1.578 2.037 0 N-CA-C 118.408 2.744 . . . . 0.0 118.408 -173.646 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 57.0 t-20 -150.15 89.01 1.55 Allowed 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 103.73 -2.693 . . . . 0.0 103.73 173.838 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 67.1 p -99.17 71.82 1.84 Allowed 'General case' 0 N--CA 1.496 1.862 0 CA-C-O 124.77 2.224 . . . . 0.0 113.93 -172.126 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -144.78 121.26 11.02 Favored 'General case' 0 CA--C 1.563 1.469 0 CA-C-N 110.645 -2.98 . . . . 0.0 104.808 173.664 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -128.08 161.12 29.97 Favored 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 122.426 1.107 . . . . 0.0 112.212 -173.587 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.39 157.57 51.64 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 115.717 1.047 . . . . 0.0 115.717 177.314 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 33.3 mm -104.52 140.41 22.66 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 121.22 -1.165 . . . . 0.0 110.925 -172.224 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.434 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 89.6 m -72.22 122.92 21.87 Favored 'General case' 0 CA--C 1.566 1.561 0 O-C-N 120.567 -1.333 . . . . 0.0 113.465 174.637 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -133.55 151.36 51.72 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.825 -1.172 . . . . 0.0 110.393 176.296 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -94.36 127.3 40.16 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 122.517 1.151 . . . . 0.0 111.271 -174.374 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 9.2 p -144.12 -16.97 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 -173.97 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 89.06 -54.4 3.98 Favored Glycine 0 N--CA 1.496 2.668 0 CA-C-N 120.64 1.564 . . . . 0.0 116.606 -178.641 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -70.32 -6.93 38.65 Favored 'General case' 0 CA--C 1.585 2.31 0 N-CA-C 117.477 2.399 . . . . 0.0 117.477 177.537 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 32.9 t . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 123.779 1.752 . . . . 0.0 111.618 175.493 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 40.0 t . . . . . 0 CA--C 1.579 2.064 0 CA-C-O 117.993 -1.003 . . . . 0.0 108.56 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -77.38 82.23 2.44 Favored 'Trans proline' 0 CA--C 1.57 2.308 0 C-N-CA 122.628 2.219 . . . . 0.0 113.97 -179.315 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 82.62 86.55 0.05 OUTLIER Pre-proline 0 CA--C 1.581 2.148 0 C-N-CA 126.776 2.03 . . . . 0.0 109.515 -174.305 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -66.3 -38.46 20.55 Favored 'Trans proline' 0 CA--C 1.565 2.069 0 N-CA-C 118.097 2.307 . . . . 0.0 118.097 -174.793 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 64.3 ttt-85 -85.33 70.02 10.78 Favored 'General case' 0 CA--C 1.577 2.001 0 CA-C-N 120.025 1.284 . . . . 0.0 110.888 174.241 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 25.31 75.11 0.01 OUTLIER Glycine 0 N--CA 1.5 2.902 0 N-CA-C 121.012 3.165 . . . . 0.0 121.012 179.716 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . 0.334 4.5 tp 46.95 28.73 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.593 2.598 0 N-CA-C 118.73 2.863 . . . . 0.0 118.73 -176.548 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.308 3.3 mp 60.13 52.87 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.592 2.575 0 C-N-CA 125.428 1.491 . . . . 0.0 112.398 177.926 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 5.6 pt -127.69 -108.78 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 120.081 -1.637 . . . . 0.0 107.762 176.865 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 57.54 68.84 0.8 Allowed 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 117.495 2.406 . . . . 0.0 117.495 172.88 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . 0.25 28.3 tp -110.13 133.78 52.87 Favored 'General case' 0 CA--C 1.581 2.136 0 O-C-N 120.665 -1.272 . . . . 0.0 109.392 174.42 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -77.18 160.5 28.91 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 119.509 -1.995 . . . . 0.0 115.369 -173.934 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.38 128.25 34.98 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 122.215 1.007 . . . . 0.0 109.855 173.409 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 96.89 24.37 13.32 Favored Glycine 0 CA--C 1.557 2.663 0 N-CA-C 116.423 1.329 . . . . 0.0 116.423 -172.967 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -129.27 139.25 51.87 Favored 'General case' 0 CA--C 1.567 1.63 0 CA-C-N 118.533 1.167 . . . . 0.0 109.427 177.638 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.8 mp -65.7 128.74 37.18 Favored 'General case' 0 CA--C 1.574 1.891 0 O-C-N 120.919 -1.113 . . . . 0.0 112.746 -178.063 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.0 p -129.16 154.09 47.08 Favored 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 -174.313 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.4 mt -85.46 -76.82 0.31 Allowed 'General case' 0 CA--C 1.568 1.64 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 173.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.8 p30 -97.35 172.92 7.47 Favored 'General case' 0 CA--C 1.577 2.002 0 CA-C-N 120.003 1.274 . . . . 0.0 113.747 172.915 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.6 m -77.75 -20.63 53.1 Favored 'General case' 0 N--CA 1.505 2.28 0 N-CA-C 116.956 2.206 . . . . 0.0 116.956 175.001 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.58 10.74 1.56 Allowed 'General case' 0 CA--C 1.575 1.928 0 N-CA-C 117.292 2.33 . . . . 0.0 117.292 174.951 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -97.17 -29.28 13.68 Favored 'General case' 0 CA--C 1.576 1.964 0 C-N-CA 125.152 1.381 . . . . 0.0 114.224 173.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 5.3 m -80.78 159.31 25.19 Favored 'General case' 0 CA--C 1.574 1.87 0 N-CA-C 115.081 1.511 . . . . 0.0 115.081 -179.521 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.7 mptt -63.51 -57.31 10.59 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 120.843 -1.161 . . . . 0.0 108.906 170.717 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.8 t -82.02 104.19 12.2 Favored 'General case' 0 CA--C 1.565 1.548 0 N-CA-C 104.537 -2.394 . . . . 0.0 104.537 170.166 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -68.59 82.31 0.27 Allowed 'General case' 0 N--CA 1.5 2.056 0 CA-C-O 124.411 2.053 . . . . 0.0 113.445 -172.89 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 49.7 t -160.7 87.17 0.74 Allowed 'General case' 0 CA--C 1.558 1.272 0 CA-C-N 112.499 -2.137 . . . . 0.0 111.421 -177.284 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 37.1 t -79.16 110.7 14.67 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 102.911 -2.996 . . . . 0.0 102.911 170.557 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.69 112.82 24.9 Favored 'General case' 0 CA--C 1.557 1.218 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -170.384 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.545 ' HB2' HG12 ' A' ' 57' ' ' VAL . 15.6 t-80 -81.02 141.18 34.65 Favored 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 124.822 1.249 . . . . 0.0 113.126 -175.702 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.2 p-10 -69.45 17.32 0.05 OUTLIER 'General case' 0 CA--C 1.591 2.558 0 N-CA-C 117.753 2.501 . . . . 0.0 117.753 172.412 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.275 43.0 p 74.75 97.59 0.07 Allowed 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 127.216 2.206 . . . . 0.0 112.402 176.683 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.276 37.3 mm 75.12 -49.98 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.387 0 C-N-CA 125.464 1.506 . . . . 0.0 115.014 174.775 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.258 0.5 OUTLIER -76.9 -121.82 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.143 0 CA-C-N 122.551 2.432 . . . . 0.0 112.965 -179.223 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 82.9 p -159.72 102.09 1.5 Allowed 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 123.943 3.065 . . . . 0.0 117.167 179.964 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 tt -164.39 105.76 0.87 Allowed 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 102.802 -3.036 . . . . 0.0 102.802 173.307 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.6 m -121.13 122.7 40.58 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.865 0.84 . . . . 0.0 112.313 -173.666 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -138.22 136.38 36.52 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 123.94 0.896 . . . . 0.0 110.627 -174.312 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 67.1 m -61.5 146.26 49.18 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 119.906 -1.746 . . . . 0.0 114.839 -177.48 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -142.74 169.58 17.3 Favored 'General case' 0 CA--C 1.567 1.601 0 CA-C-O 123.663 1.697 . . . . 0.0 115.028 -174.514 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.43 ' H ' HD23 ' A' ' 41' ' ' LEU . 2.5 pt? -91.07 167.9 12.03 Favored 'General case' 0 CA--C 1.573 1.835 0 CA-C-N 114.329 -1.305 . . . . 0.0 111.459 173.89 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.9 158.5 25.08 Favored 'General case' 0 CA--C 1.584 2.27 0 O-C-N 120.344 -1.472 . . . . 0.0 113.467 174.492 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.49 166.94 22.68 Favored 'General case' 0 CA--C 1.572 1.822 0 O-C-N 120.236 -1.54 . . . . 0.0 113.161 177.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -96.54 163.11 13.17 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.553 -1.342 . . . . 0.0 112.895 -174.408 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -63.89 129.08 38.62 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.337 0.589 . . . . 0.0 111.083 177.364 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 79.81 14.95 0.9 Allowed 'General case' 0 N--CA 1.509 2.477 0 C-N-CA 125.069 1.348 . . . . 0.0 113.758 -171.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 27.2 t -113.88 160.14 19.09 Favored 'General case' 0 CA--C 1.566 1.578 0 O-C-N 120.385 -1.447 . . . . 0.0 111.887 174.73 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 65.8 mt-10 -70.85 116.81 11.58 Favored 'General case' 0 CA--C 1.571 1.771 0 CA-C-O 122.925 1.345 . . . . 0.0 113.729 -175.69 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.446 ' HB3' ' SG ' ' A' ' 87' ' ' CYS . 15.5 p -124.04 160.5 27.55 Favored 'General case' 0 CA--C 1.568 1.644 0 CA-C-N 113.987 -1.461 . . . . 0.0 113.812 177.766 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.6 t -134.22 123.81 24.92 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 105.363 -2.088 . . . . 0.0 105.363 171.775 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.96 62.82 3.49 Favored 'General case' 0 CA--C 1.565 1.557 0 N-CA-C 115.915 1.821 . . . . 0.0 115.915 -173.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.13 141.62 25.38 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 118.742 2.867 . . . . 0.0 118.742 -172.485 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 64.8 p -141.74 147.87 38.09 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 123.396 1.57 . . . . 0.0 108.834 172.201 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -134.59 -124.25 0.16 Allowed 'General case' 0 CA--C 1.565 1.547 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 174.598 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -132.61 57.97 1.78 Allowed 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 173.476 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -169.93 -172.48 36.49 Favored Glycine 0 N--CA 1.487 2.037 0 N-CA-C 115.584 0.994 . . . . 0.0 115.584 -173.396 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.545 HG12 ' HB2' ' A' ' 30' ' ' HIS . 3.3 t -81.45 143.42 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 CA-C-O 122.233 1.016 . . . . 0.0 111.808 -172.569 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -119.33 139.89 51.22 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-O 121.909 0.862 . . . . 0.0 112.6 -173.36 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -74.64 -6.39 48.39 Favored 'General case' 0 CA--C 1.589 2.478 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 174.181 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.62 127.36 3.17 Favored 'General case' 0 CA--C 1.568 1.64 0 C-N-CA 127.302 2.241 . . . . 0.0 106.454 -174.292 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.0 m -68.29 133.57 91.33 Favored Pre-proline 0 CA--C 1.587 2.374 0 O-C-N 119.705 -1.872 . . . . 0.0 112.537 174.124 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -52.31 -0.72 0.06 OUTLIER 'Trans proline' 0 CA--C 1.57 2.279 1 N-CA-C 123.877 4.53 . . . . 0.0 123.877 -174.761 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 73.37 -40.34 0.46 Allowed 'General case' 0 N--CA 1.503 2.186 0 N-CA-C 119.019 2.97 . . . . 0.0 119.019 174.205 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.269 15.2 pt-20 -89.2 59.53 4.95 Favored 'General case' 0 CA--C 1.555 1.151 1 N-CA-C 125.568 5.396 . . . . 0.0 125.568 -172.118 . . . . . . . . 3 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.2 mtm105 -88.68 87.81 7.39 Favored 'General case' 0 N--CA 1.501 2.103 0 N-CA-C 104.959 -2.237 . . . . 0.0 104.959 168.001 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 78.8 25.25 60.65 Favored Glycine 0 CA--C 1.568 3.376 0 N-CA-C 116.705 1.442 . . . . 0.0 116.705 -170.943 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . 0.272 4.9 tt -142.13 -162.37 1.39 Allowed 'General case' 0 CA--C 1.581 2.143 0 C-N-CA 125.346 1.458 . . . . 0.0 109.576 -176.283 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -140.06 138.57 35.48 Favored 'General case' 0 CA--C 1.578 2.052 0 O-C-N 118.688 -2.507 . . . . 0.0 110.744 174.229 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 43.4 t -93.05 123.63 36.44 Favored 'General case' 0 CA--C 1.568 1.64 0 O-C-N 121.261 -0.899 . . . . 0.0 108.602 170.832 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -94.51 74.82 3.81 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.138 -1.601 . . . . 0.0 110.378 179.433 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -105.78 72.31 0.22 Allowed Glycine 0 N--CA 1.489 2.209 0 N-CA-C 115.39 0.916 . . . . 0.0 115.39 -176.158 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -71.8 -46.21 59.0 Favored 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 178.661 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -156.23 -80.62 0.08 Allowed 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 106.06 -1.83 . . . . 0.0 106.06 174.322 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 76.5 p -141.78 69.74 1.33 Allowed 'General case' 0 CA--C 1.567 1.598 0 O-C-N 121.482 -0.761 . . . . 0.0 112.794 175.14 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -89.66 77.46 7.14 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 172.355 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.8 p -96.34 -45.72 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 N-CA-C 118.156 2.65 . . . . 0.0 118.156 -170.396 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 83.55 -77.41 2.12 Favored Glycine 0 N--CA 1.494 2.509 0 O-C-N 120.998 -1.064 . . . . 0.0 113.418 -174.383 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.3 t -91.96 101.14 13.7 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 170.223 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.0 pp -52.89 143.15 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.779 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 -173.748 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 40.1 p -128.69 171.46 12.17 Favored 'General case' 0 N--CA 1.495 1.802 0 CA-C-N 112.337 -2.211 . . . . 0.0 111.576 -176.544 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -63.57 -16.31 60.49 Favored 'General case' 0 CA--C 1.582 2.203 0 N-CA-C 118.133 2.642 . . . . 0.0 118.133 177.436 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . 0.303 2.1 t -130.8 -110.28 0.26 Allowed 'General case' 0 CA--C 1.57 1.731 0 CA-C-N 121.243 1.838 . . . . 0.0 110.087 -175.162 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -160.2 106.16 1.55 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.293 -1.504 . . . . 0.0 111.757 -173.622 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -127.59 156.96 41.44 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.986 -1.072 . . . . 0.0 113.837 -176.238 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -106.17 -165.04 22.99 Favored Glycine 0 N--CA 1.492 2.426 0 C-N-CA 123.572 0.605 . . . . 0.0 113.941 173.547 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 34.0 mm -121.56 142.79 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.251 0 CA-C-O 122.472 1.129 . . . . 0.0 110.429 178.94 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.446 ' SG ' ' HB3' ' A' ' 49' ' ' CYS . 82.8 m -67.91 118.09 10.66 Favored 'General case' 0 CA--C 1.57 1.714 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 174.033 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -142.64 139.62 31.32 Favored 'General case' 0 N--CA 1.483 1.175 0 O-C-N 120.548 -1.345 . . . . 0.0 107.879 173.853 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -94.41 70.6 3.7 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 123.949 1.833 . . . . 0.0 112.027 -175.9 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.5 m -109.59 -42.32 5.21 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.691 0 CA-C-N 112.667 -2.061 . . . . 0.0 113.947 -175.265 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -80.45 -18.58 70.81 Favored Glycine 0 N--CA 1.495 2.6 0 N-CA-C 119.263 2.465 . . . . 0.0 119.263 174.849 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -86.15 80.0 8.93 Favored 'General case' 0 CA--C 1.572 1.816 0 CA-C-N 119.839 1.82 . . . . 0.0 111.73 179.1 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 42.4 m . . . . . 0 N--CA 1.504 2.25 0 N-CA-C 115.843 1.794 . . . . 0.0 115.843 -178.881 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.257 9.2 p . . . . . 0 CA--C 1.586 2.353 0 CA-C-O 114.797 -2.525 . . . . 0.0 116.311 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -76.24 96.75 1.08 Allowed 'Trans proline' 0 CA--C 1.571 2.329 0 CA-C-N 127.647 3.767 . . . . 0.0 113.016 178.464 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -104.47 93.99 6.53 Favored Pre-proline 0 CA--C 1.581 2.135 0 CA-C-O 117.746 -1.121 . . . . 0.0 112.183 -174.762 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -74.83 104.96 1.98 Allowed 'Trans proline' 0 CA--C 1.568 2.215 0 C-N-CA 122.642 2.228 . . . . 0.0 113.366 177.032 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.7 tpm_? -70.08 -29.01 65.9 Favored 'General case' 0 CA--C 1.578 2.023 0 N-CA-C 117.234 2.309 . . . . 0.0 117.234 -175.66 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -79.68 72.48 2.55 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 117.507 1.763 . . . . 0.0 117.507 -179.564 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 49.8 mm -98.38 -66.84 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 C-N-CA 123.995 0.918 . . . . 0.0 109.332 -179.229 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.9 mm -106.1 -59.12 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.261 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 173.962 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 31.7 pt -102.63 177.3 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.575 1.916 0 CA-C-N 119.531 1.059 . . . . 0.0 110.122 173.071 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 63.53 57.72 1.43 Allowed 'General case' 0 CA--C 1.582 2.18 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 pp -128.44 169.22 14.56 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 116.022 1.86 . . . . 0.0 116.022 -174.759 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -75.0 169.77 17.34 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 115.702 1.741 . . . . 0.0 115.702 -173.026 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -75.08 153.36 38.39 Favored 'General case' 0 CA--C 1.575 1.931 0 CA-C-O 122.253 1.025 . . . . 0.0 112.452 176.921 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 92.43 23.29 26.95 Favored Glycine 0 N--CA 1.496 2.643 0 N-CA-C 116.706 1.442 . . . . 0.0 116.706 -173.066 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 -135.62 142.87 45.29 Favored 'General case' 0 CA--C 1.569 1.676 0 C-N-CA 124.773 1.229 . . . . 0.0 110.805 -177.917 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.4 tp -77.9 142.21 38.57 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -174.844 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.9 p -131.88 -178.58 4.95 Favored 'General case' 0 CA--C 1.575 1.936 0 CA-C-O 123.106 1.431 . . . . 0.0 114.601 -176.201 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.9 mt -107.79 -74.59 0.65 Allowed 'General case' 0 CA--C 1.574 1.902 0 N-CA-C 104.851 -2.277 . . . . 0.0 104.851 170.603 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -95.86 -168.59 1.79 Allowed 'General case' 0 CA--C 1.587 2.384 0 CA-C-N 119.986 1.266 . . . . 0.0 113.345 171.758 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.0 m -90.15 -9.47 48.15 Favored 'General case' 0 N--CA 1.507 2.425 0 N-CA-C 117.034 2.235 . . . . 0.0 117.034 174.291 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.73 10.35 2.26 Favored 'General case' 0 CA--C 1.577 2.005 0 N-CA-C 117.395 2.368 . . . . 0.0 117.395 175.24 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -94.2 -29.88 14.88 Favored 'General case' 0 CA--C 1.569 1.693 0 C-N-CA 124.807 1.243 . . . . 0.0 113.821 176.866 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . 0.259 80.4 m -81.99 -172.72 4.09 Favored 'General case' 0 CA--C 1.585 2.314 0 CA-C-N 121.866 2.121 . . . . 0.0 111.382 173.035 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -56.11 -69.87 0.13 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 119.345 -2.097 . . . . 0.0 116.646 -172.014 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.0 t -86.86 -72.51 0.5 Allowed 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 122.053 0.93 . . . . 0.0 111.443 174.315 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -172.17 63.96 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.937 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.63 -174.017 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 37.5 t -139.74 71.84 1.39 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 119.368 -2.082 . . . . 0.0 116.378 -173.731 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.3 t -98.03 123.86 42.25 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 170.637 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -103.23 120.3 40.48 Favored 'General case' 0 CA--C 1.573 1.835 0 CA-C-O 122.956 1.36 . . . . 0.0 114.053 -172.456 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.522 ' HB2' HG12 ' A' ' 57' ' ' VAL . 2.1 t60 -86.07 133.37 33.9 Favored 'General case' 0 CA--C 1.562 1.422 0 C-N-CA 125.322 1.449 . . . . 0.0 112.389 -177.482 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -82.69 59.04 4.53 Favored 'General case' 0 CA--C 1.58 2.119 0 O-C-N 120.63 -1.294 . . . . 0.0 114.39 173.935 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . 0.256 6.0 t 48.38 88.55 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.316 0 N-CA-C 116.897 2.184 . . . . 0.0 116.897 175.857 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.3 4.2 mp 73.92 -57.57 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.633 0 C-N-CA 125.419 1.488 . . . . 0.0 111.325 -178.734 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.0 mt -62.29 114.28 3.38 Favored 'General case' 0 N--CA 1.496 1.873 0 CA-C-N 120.833 1.651 . . . . 0.0 109.572 173.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.0 p -85.46 50.04 1.88 Allowed 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 120.257 3.429 . . . . 0.0 120.257 -171.135 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.3 tt -92.37 85.92 5.53 Favored 'General case' 0 N--CA 1.498 1.955 0 N-CA-C 101.799 -3.408 . . . . 0.0 101.799 169.981 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.419 ' HB3' HG11 ' A' ' 57' ' ' VAL . 51.0 m -94.75 109.59 21.53 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 122.464 1.126 . . . . 0.0 112.889 -170.545 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 29.9 ttt85 -123.94 135.5 53.71 Favored 'General case' 0 CA--C 1.562 1.414 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.267 -175.357 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 95.1 m -65.65 145.15 56.39 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 123.779 1.752 . . . . 0.0 114.103 -179.695 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -138.09 -173.08 3.42 Favored 'General case' 0 CA--C 1.566 1.564 0 CA-C-N 113.535 -1.666 . . . . 0.0 112.887 -174.177 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 pp -80.62 151.51 28.99 Favored 'General case' 0 CA--C 1.572 1.791 0 CA-C-O 122.86 1.314 . . . . 0.0 113.506 175.395 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.1 pttt -80.94 143.27 32.74 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 123.616 0.766 . . . . 0.0 110.591 173.66 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.01 152.68 38.7 Favored 'General case' 0 CA--C 1.568 1.669 0 N-CA-C 118.108 2.633 . . . . 0.0 118.108 -171.995 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -102.7 170.23 8.14 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 113.141 -1.845 . . . . 0.0 112.683 -178.533 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -50.18 130.11 22.18 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 115.176 1.547 . . . . 0.0 115.176 -174.727 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 69.32 31.63 3.82 Favored 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -173.35 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 43.4 m -129.8 153.76 47.92 Favored 'General case' 0 CA--C 1.566 1.583 0 CA-C-O 122.763 1.268 . . . . 0.0 111.345 174.98 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -74.72 115.0 13.81 Favored 'General case' 0 CA--C 1.571 1.769 0 CA-C-O 123.462 1.601 . . . . 0.0 113.537 -176.579 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 13.7 p -111.18 152.75 26.69 Favored 'General case' 0 CA--C 1.562 1.439 0 CA-C-N 113.596 -1.638 . . . . 0.0 112.229 174.57 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.9 m -77.46 108.36 10.57 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.363 -1.461 . . . . 0.0 107.546 174.292 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.94 -54.43 7.24 Favored 'General case' 0 CA--C 1.564 1.497 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -172.557 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -93.28 138.32 31.76 Favored 'General case' 0 CA--C 1.565 1.531 0 CA-C-N 118.582 0.628 . . . . 0.0 109.508 173.641 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.8 p -110.34 142.32 42.15 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 123.441 1.591 . . . . 0.0 111.901 178.138 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.72 -144.03 0.3 Allowed 'General case' 0 CA--C 1.568 1.664 0 CA-C-N 113.203 -1.817 . . . . 0.0 108.902 174.115 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -121.21 75.38 1.16 Allowed 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 103.729 -2.693 . . . . 0.0 103.729 171.474 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 174.32 -162.35 32.66 Favored Glycine 0 N--CA 1.485 1.934 0 CA-C-O 122.908 1.282 . . . . 0.0 116.295 -174.549 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.522 HG12 ' HB2' ' A' ' 30' ' ' HIS . 18.6 t -79.29 145.51 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 CA-C-O 122.841 1.305 . . . . 0.0 111.336 -176.032 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -115.35 138.78 50.61 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.016 -173.845 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -66.06 -30.83 71.42 Favored 'General case' 0 CA--C 1.587 2.386 0 O-C-N 120.034 -1.667 . . . . 0.0 115.332 -176.164 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.5 mtmm -153.82 113.49 3.83 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 102.902 -2.999 . . . . 0.0 102.902 172.794 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 67.9 m -39.85 150.23 0.26 Allowed Pre-proline 0 CA--C 1.599 2.837 0 N-CA-C 119.919 3.303 . . . . 0.0 119.919 -173.521 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -69.1 58.46 1.24 Allowed 'Trans proline' 0 CA--C 1.579 2.765 0 N-CA-C 121.674 3.682 . . . . 0.0 121.674 -173.822 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 3.4 t 61.34 162.7 0.07 Allowed 'General case' 0 CA--C 1.582 2.201 0 N-CA-C 117.823 2.527 . . . . 0.0 117.823 174.182 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -75.63 160.37 30.17 Favored 'General case' 0 CA--C 1.574 1.888 0 N-CA-C 115.494 1.665 . . . . 0.0 115.494 178.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -63.23 120.35 11.37 Favored 'General case' 0 CA--C 1.572 1.818 0 CA-C-O 122.553 1.168 . . . . 0.0 113.073 -179.111 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.19 -28.26 15.91 Favored Glycine 0 N--CA 1.498 2.81 0 N-CA-C 116.846 1.498 . . . . 0.0 116.846 -173.219 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.4 mp -98.65 144.9 27.42 Favored 'General case' 0 CA--C 1.565 1.539 0 CA-C-O 122.412 1.101 . . . . 0.0 111.944 -179.128 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.78 153.59 18.64 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 122.083 0.944 . . . . 0.0 112.489 -178.708 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 5.1 t -92.77 96.52 10.2 Favored 'General case' 0 CA--C 1.57 1.719 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.825 174.717 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -97.77 103.63 15.58 Favored 'General case' 0 CA--C 1.57 1.738 0 O-C-N 120.436 -1.415 . . . . 0.0 113.431 -173.966 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 154.94 -56.77 0.41 Allowed Glycine 0 N--CA 1.499 2.87 0 N-CA-C 118.994 2.358 . . . . 0.0 118.994 174.933 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 67.98 -19.5 0.14 Allowed 'General case' 0 CA--C 1.582 2.177 0 N-CA-C 118.767 2.877 . . . . 0.0 118.767 -174.961 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -142.43 122.04 13.35 Favored 'General case' 0 CA--C 1.567 1.628 0 CA-C-N 120.482 1.492 . . . . 0.0 109.651 175.271 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.8 t -92.15 86.92 5.93 Favored 'General case' 0 CA--C 1.56 1.354 0 O-C-N 120.759 -1.213 . . . . 0.0 111.413 -177.774 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 28.4 tp -57.65 -36.25 71.62 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 174.756 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 82.0 t -81.1 72.68 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.585 2.323 0 CA-C-O 122.942 1.353 . . . . 0.0 107.406 172.696 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 129.04 37.12 0.4 Allowed Glycine 0 CA--C 1.556 2.628 0 N-CA-C 116.488 1.355 . . . . 0.0 116.488 -173.45 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.9 m -95.77 74.05 3.13 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 119.519 1.66 . . . . 0.0 113.08 179.268 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.6 mp -110.13 -64.49 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 N-CA-C 105.536 -2.024 . . . . 0.0 105.536 173.689 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.4 p -84.06 -172.23 4.05 Favored 'General case' 0 CA--C 1.576 1.943 0 CA-C-O 122.863 1.316 . . . . 0.0 111.272 172.87 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -71.18 70.23 0.55 Allowed 'General case' 0 CA--C 1.575 1.935 0 O-C-N 120.291 -1.505 . . . . 0.0 112.713 174.899 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 41.0 p -97.87 71.55 2.2 Favored 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 125.999 2.809 . . . . 0.0 110.769 -174.83 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -90.72 72.84 6.7 Favored 'General case' 0 CA--C 1.566 1.569 0 CA-C-N 111.049 -2.796 . . . . 0.0 110.59 -176.099 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -125.94 149.93 48.38 Favored 'General case' 0 CA--C 1.559 1.327 0 N-CA-C 115.528 1.677 . . . . 0.0 115.528 -172.974 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -108.12 166.75 13.09 Favored Glycine 0 CA--C 1.548 2.154 0 CA-C-N 113.596 -1.638 . . . . 0.0 109.443 170.055 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 38.2 mm -102.37 135.59 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 120.23 -1.747 . . . . 0.0 109.322 179.019 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 28.6 m -62.98 119.52 9.6 Favored 'General case' 0 CA--C 1.572 1.791 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 174.235 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -139.58 153.63 47.43 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 122.452 1.12 . . . . 0.0 109.775 174.902 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -94.22 69.6 3.75 Favored 'General case' 0 N--CA 1.496 1.858 0 CA-C-O 124.02 1.867 . . . . 0.0 115.688 -172.272 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.4 t -82.37 -40.07 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 CA-C-N 112.89 -1.959 . . . . 0.0 112.572 174.752 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -72.87 -1.13 54.38 Favored Glycine 0 N--CA 1.498 2.787 0 N-CA-C 120.592 2.997 . . . . 0.0 120.592 174.85 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 35.7 ttp-105 -129.95 -71.9 0.59 Allowed 'General case' 0 CA--C 1.568 1.639 0 CA-C-N 119.483 1.642 . . . . 0.0 109.196 172.83 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 92.0 p . . . . . 0 N--CA 1.493 1.709 0 CA-C-O 124.222 1.963 . . . . 0.0 112.657 176.271 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.256 9.3 p . . . . . 0 CA--C 1.587 2.387 0 CA-C-O 114.507 -2.663 . . . . 0.0 115.898 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -74.81 75.9 3.47 Favored 'Trans proline' 0 CA--C 1.574 2.524 0 CA-C-N 127.539 3.728 . . . . 0.0 115.453 179.722 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 60.89 69.74 1.05 Allowed Pre-proline 0 CA--C 1.589 2.448 0 C-N-CA 125.441 1.496 . . . . 0.0 113.676 -174.738 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -86.78 155.69 8.8 Favored 'Trans proline' 0 CA--C 1.567 2.157 0 C-N-CA 122.403 2.069 . . . . 0.0 115.554 -176.147 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -84.3 70.33 10.59 Favored 'General case' 0 CA--C 1.577 1.998 0 CA-C-O 122.75 1.262 . . . . 0.0 110.73 174.248 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 161.54 100.31 0.15 Allowed Glycine 0 N--CA 1.486 1.989 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.513 -174.492 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 63.7 mt -87.84 80.03 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 CA-C-O 122.533 1.159 . . . . 0.0 108.62 -175.075 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 1.8 pp -85.34 54.98 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.36 0 N-CA-C 114.841 1.422 . . . . 0.0 114.841 -174.891 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.4 pt -122.4 -146.54 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.581 2.145 0 O-C-N 120.695 -1.253 . . . . 0.0 110.407 -179.308 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 63.37 67.05 0.67 Allowed 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 178.94 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -122.11 151.18 41.2 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 123.866 1.794 . . . . 0.0 115.61 -179.214 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -83.0 166.46 18.79 Favored 'General case' 0 CA--C 1.572 1.819 0 CA-C-N 114.503 -1.226 . . . . 0.0 112.59 173.931 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.44 149.18 33.3 Favored 'General case' 0 CA--C 1.578 2.029 0 O-C-N 120.658 -1.276 . . . . 0.0 109.879 173.677 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.8 30.42 18.06 Favored Glycine 0 CA--C 1.559 2.84 0 O-C-N 121.236 -0.915 . . . . 0.0 114.979 -171.724 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -137.27 141.41 41.97 Favored 'General case' 0 CA--C 1.565 1.542 0 C-N-CA 125.024 1.33 . . . . 0.0 109.528 -174.024 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.7 tt -69.63 117.73 11.6 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.906 -1.121 . . . . 0.0 111.785 -179.054 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 39' ' ' CYS . 22.0 p -124.98 155.68 39.26 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 122.083 0.944 . . . . 0.0 113.222 -175.654 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.1 mp -91.4 -77.48 0.42 Allowed 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 173.841 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -92.38 164.9 13.32 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 115.504 1.668 . . . . 0.0 115.504 174.968 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.3 m -70.6 -22.78 62.51 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 116.474 2.028 . . . . 0.0 116.474 175.434 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.89 6.84 5.52 Favored 'General case' 0 CA--C 1.58 2.111 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 173.095 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -91.82 -41.49 10.62 Favored 'General case' 0 CA--C 1.565 1.527 0 C-N-CA 124.67 1.188 . . . . 0.0 111.899 174.148 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 74.4 m -77.41 136.77 38.43 Favored 'General case' 0 CA--C 1.571 1.787 0 CA-C-N 121.082 1.764 . . . . 0.0 110.476 174.05 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -44.58 -37.43 3.58 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 120.976 3.695 . . . . 0.0 120.976 -172.247 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.2 m -80.69 -83.26 0.11 Allowed 'General case' 0 CA--C 1.57 1.718 0 CA-C-N 118.472 0.578 . . . . 0.0 110.361 173.928 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -175.77 31.08 0.0 OUTLIER 'General case' 0 CA--C 1.588 2.431 0 C-N-CA 124.497 1.119 . . . . 0.0 113.138 -178.255 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 36.7 t -134.9 102.24 5.17 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 118.989 2.959 . . . . 0.0 118.989 -170.506 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 49.5 t -106.03 113.42 26.95 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 102.568 -3.123 . . . . 0.0 102.568 169.018 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.15 123.82 42.39 Favored 'General case' 0 CA--C 1.564 1.484 0 CA-C-O 122.059 0.933 . . . . 0.0 112.297 -173.065 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 20.4 t-80 -77.92 165.45 24.08 Favored 'General case' 0 CA--C 1.567 1.63 0 CA-C-O 122.656 1.217 . . . . 0.0 114.052 -174.742 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -80.35 -101.82 0.03 OUTLIER 'General case' 0 CA--C 1.577 2.006 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 172.631 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.1 p -150.77 90.93 1.67 Allowed 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 120.498 1.499 . . . . 0.0 108.112 174.148 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . 0.271 5.9 mt 70.58 -31.6 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.512 2.67 0 N-CA-C 115.943 1.831 . . . . 0.0 115.943 174.603 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.4 tp -76.62 -123.31 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.151 0 CA-C-N 121.724 2.056 . . . . 0.0 111.03 174.938 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.0 p -162.05 92.82 0.86 Allowed 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 122.433 2.379 . . . . 0.0 114.986 178.11 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.0 tp -150.86 83.83 1.34 Allowed 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 104.067 -2.568 . . . . 0.0 104.067 172.746 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.8 m -104.5 131.34 51.99 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 122.646 1.213 . . . . 0.0 112.795 -173.29 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -131.71 134.82 46.32 Favored 'General case' 0 CA--C 1.562 1.419 0 C-N-CA 124.53 1.132 . . . . 0.0 108.951 -178.659 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 17' ' ' CYS . 99.4 m -65.26 146.92 54.32 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 119.874 -1.766 . . . . 0.0 113.9 178.409 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.42 179.73 6.49 Favored 'General case' 0 CA--C 1.564 1.513 0 CA-C-N 113.979 -1.464 . . . . 0.0 114.025 -173.368 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 98.1 mt -81.26 149.25 29.08 Favored 'General case' 0 CA--C 1.568 1.664 0 CA-C-O 122.097 0.951 . . . . 0.0 112.492 176.118 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -75.99 153.38 36.57 Favored 'General case' 0 CA--C 1.573 1.855 0 CA-C-O 121.856 0.836 . . . . 0.0 111.458 173.943 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.61 157.4 31.95 Favored 'General case' 0 CA--C 1.568 1.655 0 N-CA-C 116.856 2.169 . . . . 0.0 116.856 -173.252 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 43.2 mtp180 -117.58 172.03 7.62 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 113.257 -1.792 . . . . 0.0 111.308 179.45 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -48.59 132.46 17.33 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 116.216 1.932 . . . . 0.0 116.216 -172.972 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.6 m120 72.75 18.42 4.19 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -173.934 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.4 t -114.45 151.71 32.76 Favored 'General case' 0 CA--C 1.567 1.632 0 CA-C-O 123.11 1.433 . . . . 0.0 112.599 176.096 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -76.74 101.79 5.96 Favored 'General case' 0 CA--C 1.57 1.718 0 C-N-CA 124.86 1.264 . . . . 0.0 113.291 -177.706 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.468 ' SG ' ' HA ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -99.05 156.52 16.89 Favored 'General case' 0 CA--C 1.564 1.493 0 CA-C-O 123.09 1.424 . . . . 0.0 113.793 177.254 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.1 t -82.46 96.9 8.15 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 171.522 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.6 -47.42 40.54 Favored 'General case' 0 CA--C 1.566 1.583 0 N-CA-C 115.926 1.825 . . . . 0.0 115.926 -173.304 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -89.03 153.12 21.26 Favored 'General case' 0 CA--C 1.57 1.746 0 C-N-CA 123.792 0.837 . . . . 0.0 109.547 172.904 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.1 p -126.27 146.74 49.88 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 123.946 1.831 . . . . 0.0 111.86 176.775 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -105.79 -53.0 2.72 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-N 112.869 -1.969 . . . . 0.0 113.355 175.144 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -164.76 -54.45 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.915 0 C-N-CA 127.14 2.176 . . . . 0.0 107.761 -174.875 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 112.01 94.36 2.19 Favored Glycine 0 N--CA 1.474 1.2 0 N-CA-C 116.916 1.526 . . . . 0.0 116.916 174.513 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.6 t -115.79 140.22 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 119.427 -2.219 . . . . 0.0 107.132 110.157 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -116.9 135.86 53.4 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -172.286 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -64.36 -41.48 96.71 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.616 -1.302 . . . . 0.0 113.377 174.23 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -142.2 110.59 6.05 Favored 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 103.549 -2.759 . . . . 0.0 103.549 172.503 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 57.1 m -53.02 161.5 1.22 Allowed Pre-proline 0 CA--C 1.588 2.427 0 N-CA-C 118.262 2.69 . . . . 0.0 118.262 -174.817 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.468 ' HA ' ' SG ' ' A' ' 49' ' ' CYS . 77.8 Cg_exo -53.86 172.34 0.27 Allowed 'Trans proline' 0 CA--C 1.573 2.436 0 C-N-CA 122.954 2.436 . . . . 0.0 117.984 174.917 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 63.0 m -71.5 147.33 47.86 Favored 'General case' 0 CA--C 1.569 1.703 0 O-C-N 120.849 -1.157 . . . . 0.0 113.388 174.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -65.46 153.12 42.27 Favored 'General case' 0 CA--C 1.572 1.825 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 179.006 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 38.7 ttp180 -40.42 -35.65 0.46 Allowed 'General case' 0 N--CA 1.507 2.411 0 N-CA-C 121.574 3.916 . . . . 0.0 121.574 -174.606 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -68.42 -25.06 74.98 Favored Glycine 0 CA--C 1.555 2.551 0 N-CA-C 119.985 2.754 . . . . 0.0 119.985 173.933 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -135.28 169.22 17.81 Favored 'General case' 0 CA--C 1.574 1.883 0 CA-C-N 120.21 2.005 . . . . 0.0 114.159 179.16 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -98.68 158.17 15.79 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 -173.707 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.7 t -94.86 128.3 41.51 Favored 'General case' 0 CA--C 1.57 1.723 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.046 171.451 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -93.19 98.94 11.61 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.006 -1.684 . . . . 0.0 108.152 -178.126 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.01 38.69 0.06 OUTLIER Glycine 0 N--CA 1.498 2.774 1 N-CA-C 124.728 4.651 . . . . 0.0 124.728 -172.979 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -86.35 82.74 7.88 Favored 'General case' 0 CA--C 1.571 1.755 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 164.204 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.35 49.32 0.58 Allowed 'General case' 0 CA--C 1.576 1.978 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -173.592 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.0 t 58.73 -77.07 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 126.918 2.087 . . . . 0.0 115.841 174.752 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 38.0 tp 65.01 -57.54 0.28 Allowed 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 178.269 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 97.3 t -87.13 78.98 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.573 1.854 0 CA-C-O 122.665 1.221 . . . . 0.0 109.576 -176.511 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -158.69 72.61 0.23 Allowed Glycine 0 N--CA 1.491 2.317 0 O-C-N 121.505 -0.747 . . . . 0.0 113.82 179.388 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.2 t 49.46 35.34 7.99 Favored 'General case' 0 N--CA 1.506 2.362 0 N-CA-C 118.257 2.688 . . . . 0.0 118.257 -179.638 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.345 0.2 OUTLIER 44.01 67.83 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.514 2.753 0 CA-C-O 124.449 2.071 . . . . 0.0 114.548 -174.877 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 18.2 p -117.62 163.77 15.96 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-O 124.403 2.049 . . . . 0.0 113.72 -174.476 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -70.16 -0.17 7.32 Favored 'General case' 0 CA--C 1.578 2.054 0 N-CA-C 119.064 2.986 . . . . 0.0 119.064 174.981 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 76.0 p -98.18 71.73 2.12 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 124.648 2.166 . . . . 0.0 111.411 -175.763 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -96.05 74.16 3.01 Favored 'General case' 0 CA--C 1.568 1.665 0 CA-C-N 111.764 -2.471 . . . . 0.0 110.19 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -121.34 144.95 48.37 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 116.405 2.002 . . . . 0.0 116.405 -172.216 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -107.72 151.03 16.96 Favored Glycine 0 CA--C 1.548 2.125 0 CA-C-N 114.458 -1.246 . . . . 0.0 111.19 173.453 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 24.7 mm -92.52 134.91 29.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 120.099 -1.824 . . . . 0.0 110.583 -166.464 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 98.8 m -63.98 123.59 19.39 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 175.013 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -143.73 151.63 40.27 Favored 'General case' 0 CA--C 1.563 1.449 0 CA-C-O 123.612 1.672 . . . . 0.0 110.532 174.875 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -98.08 79.72 2.63 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 124.422 2.058 . . . . 0.0 111.26 -176.071 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.9 t -105.72 74.16 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.707 0 CA-C-N 112.012 -2.358 . . . . 0.0 108.056 -175.636 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -79.91 58.51 4.54 Favored Glycine 0 N--CA 1.497 2.706 0 N-CA-C 116.727 1.451 . . . . 0.0 116.727 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 -93.71 82.67 4.34 Favored 'General case' 0 CA--C 1.569 1.692 0 CA-C-O 122.293 1.045 . . . . 0.0 111.253 -176.49 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.9 t . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 124.022 1.867 . . . . 0.0 114.303 -175.85 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' ' OH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_