data_2kz8_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 2kz8 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mtt . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.867 0.365 . . . . 71.03 110.88 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.34 -170.58 0.53 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 75.44 110.846 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.435 ' O ' ' N ' ' A' ' 7' ' ' HIS . 0.1 OUTLIER 174.27 59.1 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.596 0.713 . . . . 74.45 110.847 179.922 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -2.64 10.54 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.689 2.259 . . . . 74.04 112.328 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.5 m -84.08 -43.14 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.255 -0.429 . . . . 73.21 111.106 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.77 -28.62 3.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 74.21 110.888 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.435 ' N ' ' O ' ' A' ' 3' ' ' CYS . 21.3 m-70 67.66 46.31 1.35 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 72.33 110.878 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -107.6 -74.05 0.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.434 . . . . 75.22 110.872 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.81 -134.72 8.55 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.719 -0.753 . . . . 73.12 112.483 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -155.19 88.26 1.16 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 72.33 110.863 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.521 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -48.97 105.5 0.08 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 75.52 110.895 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.9 p -142.01 126.65 16.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 74.24 111.145 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.4 p -49.09 130.98 19.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 73.31 110.865 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.411 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 178.94 80.76 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.748 -0.739 . . . . 74.04 112.464 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.411 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -37.12 146.83 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.93 0.395 . . . . 74.44 111.108 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.8 -165.51 1.66 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.124 -0.489 . . . . 73.34 110.893 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.59 116.97 29.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.235 -0.439 . . . . 75.12 110.907 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.2 mm -107.59 91.96 7.93 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.652 0.739 . . . . 74.22 111.142 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 96.89 0.61 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.654 2.236 . . . . 72.51 112.344 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -64.5 -36.92 85.74 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 75.53 110.919 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 16.7 m -128.87 146.79 50.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 63.33 111.139 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.8 p90 -143.87 36.18 1.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 73.4 110.882 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.55 -40.23 2.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 75.55 110.854 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -157.42 -57.92 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.713 -0.756 . . . . 64.21 112.478 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.18 46.31 1.3 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.876 0.37 . . . . 74.34 110.882 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -53.09 116.48 2.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 73.32 110.887 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 t -130.74 92.55 3.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 73.42 111.123 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 44.5 t -77.07 127.55 38.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 73.31 111.073 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.4 ' O ' ' C ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -85.05 51.43 2.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 73.25 110.893 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 29' ' ' LEU . 19.0 mttm -38.08 107.69 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 75.42 110.933 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 119.45 46.58 0.4 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.764 -0.732 . . . . 73.35 112.534 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 15.1 mm -107.73 91.69 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.884 0.373 . . . . 74.32 111.117 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.27 154.61 38.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 61.35 110.883 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 168.32 -109.33 0.33 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.761 -0.733 . . . . 62.31 112.502 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.521 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 53.8 mt -156.98 87.0 0.98 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.856 0.36 . . . . 73.12 110.897 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -159.73 160.18 33.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 74.34 110.921 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.7 t -171.82 -40.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.137 -0.483 . . . . 73.4 110.905 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 p -120.9 -46.54 2.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 75.2 111.139 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -92.1 170.65 9.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.494 . . . . 71.53 110.807 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.47 21.12 2.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.196 -0.456 . . . . 74.13 110.877 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -112.0 -61.79 1.66 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 73.43 110.863 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -77.34 61.67 2.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 65.02 110.874 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.0 p -95.24 154.28 17.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 74.12 110.859 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 19.0 mm -140.89 139.84 33.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 74.12 111.136 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.6 mtt -142.15 143.84 33.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 73.43 110.909 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.1 m-20 -92.51 -169.67 2.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.236 -0.438 . . . . 64.13 110.893 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -60.92 2.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 74.35 110.902 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.91 -57.58 8.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.262 -0.427 . . . . 75.02 110.857 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.72 -58.01 6.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 73.14 110.865 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.8 t -53.65 -42.64 68.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 73.11 110.809 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.2 -44.14 83.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.164 -0.471 . . . . 72.14 110.856 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.14 -62.08 1.75 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 74.22 111.093 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -52.05 -46.21 65.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 75.51 110.834 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.94 -51.33 64.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 72.25 110.905 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -50.51 -40.24 50.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.444 . . . . 64.21 111.099 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -72.07 -67.85 0.51 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 74.14 110.902 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.2 m -46.47 -36.87 3.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.448 . . . . 74.13 111.135 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.62 -50.73 33.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 73.22 110.908 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.11 -50.99 60.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 72.22 111.066 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.53 -46.16 77.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 75.13 110.874 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.48 -51.51 35.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.133 -0.485 . . . . 73.13 110.872 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.37 -54.68 25.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 75.13 111.095 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.08 -40.53 32.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.243 -0.435 . . . . 54.3 110.86 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 42.4 t -79.68 -27.4 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.132 -0.485 . . . . 72.52 111.15 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 74.43 110.905 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 4.6 m . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.847 0.356 . . . . 73.32 111.1 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -106.02 159.41 29.74 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.587 0.708 . . . . 64.23 111.079 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 -7.54 21.34 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.682 2.255 . . . . 72.52 112.292 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -92.19 -39.5 11.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 71.53 110.876 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -57.34 -61.17 2.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 71.33 110.88 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -44.74 -68.11 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 74.21 111.136 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.1 m -48.85 -39.09 11.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 75.25 111.144 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.6 mtmt -60.4 -39.41 87.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 75.23 110.9 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 99.6 t -70.35 -37.97 72.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 74.5 111.167 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.66 -33.33 72.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 72.44 110.859 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.1 pttt -89.53 -19.25 25.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 74.11 110.886 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 21.8 ttmt -75.97 -51.19 12.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 71.23 110.87 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.3 mt -92.09 14.66 15.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.205 -0.452 . . . . 75.3 110.915 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.32 41.13 27.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 64.43 110.881 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -79.04 86.46 4.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.138 -0.483 . . . . 74.32 110.872 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -45.83 156.05 0.15 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 70.51 111.157 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.23 -19.41 54.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 75.24 110.883 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -53.21 6.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 75.15 110.917 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -62.63 -49.34 75.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.234 -0.439 . . . . 72.55 110.946 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.57 -31.64 62.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 73.15 111.153 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 24.5 p -80.02 -35.79 36.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 64.13 110.885 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -74.81 -22.82 58.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.09 -0.504 . . . . 73.53 110.904 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 52.8 mt -103.71 -62.87 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 75.43 111.142 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -75.64 -63.95 1.18 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 75.43 110.902 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 124.69 34.36 0.7 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.731 -0.747 . . . . 63.14 112.475 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -52.01 -50.14 46.2 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.743 -0.741 . . . . 41.52 112.51 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.95 -137.11 13.88 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.739 -0.743 . . . . 74.32 112.526 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.14 -73.36 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.781 0.324 . . . . 63.43 111.147 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -85.25 40.94 0.85 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 71.14 110.89 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -60.35 -75.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 74.33 111.053 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.417 ' C ' ' O ' ' A' ' 98' ' ' ALA . 25.4 m-85 -36.38 -47.03 0.58 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 75.24 110.849 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.1 m -57.38 -76.08 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.481 . . . . 74.31 110.899 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -47.39 -52.8 15.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.08 -0.509 . . . . 75.44 110.859 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -49.67 -38.26 31.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 73.52 110.923 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -54.33 -38.85 66.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.13 -0.486 . . . . 74.53 110.894 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.22 -17.32 22.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.139 -0.482 . . . . 74.44 110.916 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.28 26.19 16.7 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.751 -0.738 . . . . 73.05 112.47 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 74.7 m-80 -94.3 -24.65 17.34 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.863 0.363 . . . . 71.42 110.925 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -105.05 18.7 21.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 43.5 111.085 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.529 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.6 tm0? -120.39 55.98 4.39 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.637 0.732 . . . . 71.15 110.941 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.4 Cg_endo -69.77 28.67 0.18 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.664 2.243 . . . . 75.43 112.334 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.694 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.9 OUTLIER 69.42 38.37 0.17 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.547 0.689 . . . . 74.34 110.842 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.694 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.5 Cg_endo -69.7 -165.49 0.15 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.689 2.259 . . . . 74.13 112.369 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 14.1 m -81.46 -34.41 31.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 63.14 110.845 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 14.8 m -48.78 -42.34 35.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 73.42 111.192 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 27.7 mm -60.26 -44.0 94.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 75.11 111.133 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -29.34 70.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.169 -0.469 . . . . 73.22 110.864 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.6 mp -81.24 -42.83 20.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.244 -0.435 . . . . 74.04 110.881 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.419 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 36.1 mt -61.09 -49.45 77.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 73.2 110.925 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 15.7 ptp180 -51.92 -39.76 59.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 72.2 110.914 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 33.8 m -88.13 -13.01 10.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 74.33 111.092 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.419 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.4 OUTLIER -79.06 -41.35 29.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 72.21 110.874 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -48.79 -32.82 9.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 72.41 110.876 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.2 -21.39 17.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 74.04 110.941 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 42.1 m-70 -126.52 87.66 55.94 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.552 0.691 . . . . 63.5 110.863 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.71 3.37 2.78 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.692 2.261 . . . . 63.34 112.392 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -117.22 -12.45 10.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.177 -0.465 . . . . 74.54 110.898 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.06 -46.57 72.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.168 -0.469 . . . . 73.41 110.932 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.403 ' O ' ' HB3' ' A' ' 131' ' ' ARG . 1.7 pt? -49.73 -29.42 7.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 64.0 110.891 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . 0.472 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.59 -27.55 23.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 73.41 110.885 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -94.68 5.03 53.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 74.2 110.859 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . 0.402 HG12 ' HA ' ' A' ' 127' ' ' LEU . 11.6 pt -124.29 -35.12 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.471 . . . . 75.14 111.117 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.472 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.2 ptt-85 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.178 -0.465 . . . . 73.22 110.893 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.895 0.379 . . . . 71.03 110.917 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.83 -169.04 0.39 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 75.44 110.893 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.8 p 176.73 59.86 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.382 0 CA-C-O 121.576 0.703 . . . . 74.45 110.883 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.84 4.8 2.02 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.646 2.231 . . . . 74.04 112.297 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.2 m -104.01 -45.79 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.436 . . . . 73.21 111.141 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.4 m -107.77 -34.15 7.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 74.21 110.885 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 61.03 46.45 8.3 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.089 -0.505 . . . . 72.33 110.896 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -109.35 -74.21 0.66 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.166 -0.47 . . . . 75.22 110.943 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -107.95 -106.9 3.12 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.695 -0.764 . . . . 73.12 112.535 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -176.56 96.37 0.05 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.89 0.376 . . . . 72.33 110.889 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.566 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.8 ptp -52.58 104.76 0.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.168 -0.469 . . . . 75.52 110.92 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.2 p -143.02 126.1 13.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.254 -0.43 . . . . 74.24 111.151 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -49.77 128.37 17.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.124 -0.489 . . . . 73.31 110.861 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.416 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.26 84.28 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.778 -0.725 . . . . 74.04 112.532 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.416 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.67 145.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.872 0.368 . . . . 74.44 111.146 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.53 -167.28 2.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 73.34 110.856 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.44 118.15 30.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 75.12 110.86 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.3 mm -109.28 91.17 9.28 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.667 0.746 . . . . 74.22 111.161 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.67 95.81 0.56 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.745 2.297 . . . . 72.51 112.404 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -63.43 -37.27 86.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 75.53 110.901 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.408 ' HB ' ' HA ' ' A' ' 26' ' ' LYS . 19.2 m -131.21 149.67 52.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.091 -0.504 . . . . 63.33 111.205 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -148.51 44.22 1.02 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.27 -0.423 . . . . 73.4 110.926 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.29 -46.14 0.77 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.117 -0.492 . . . . 75.55 110.84 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -149.08 -50.46 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.67 -0.776 . . . . 64.21 112.469 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.7 47.1 0.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.912 0.387 . . . . 74.34 110.876 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.408 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 14.8 tttt -55.33 121.62 9.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 73.32 110.9 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.8 t -138.52 93.83 2.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 73.42 111.134 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 44.2 t -77.55 128.14 38.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 73.31 111.104 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.414 ' O ' ' C ' ' A' ' 30' ' ' LYS . 0.2 OUTLIER -84.51 51.92 2.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 73.25 110.955 179.906 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 29' ' ' LEU . 29.0 mttp -37.4 107.7 0.07 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 75.42 110.859 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.27 50.05 0.39 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.713 -0.756 . . . . 73.35 112.478 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 19.0 mm -109.36 93.04 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.787 0.327 . . . . 74.32 111.166 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.27 150.7 38.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 61.35 110.822 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.9 -106.12 0.25 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.805 -0.712 . . . . 62.31 112.501 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.566 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 43.5 mt -156.65 84.82 0.97 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.875 0.369 . . . . 73.12 110.873 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.465 ' CD1' ' N ' ' A' ' 36' ' ' TYR . 0.0 OUTLIER -158.74 162.51 37.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 74.34 110.916 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.2 t -171.28 -37.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.094 -0.503 . . . . 73.4 110.904 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -128.13 -40.56 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 75.2 111.141 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -97.05 170.89 8.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.129 -0.487 . . . . 71.53 110.835 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.25 12.96 2.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.216 -0.447 . . . . 74.13 110.866 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -103.07 -65.2 1.01 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 73.43 110.872 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -76.98 61.46 1.97 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.193 -0.458 . . . . 65.02 110.886 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.5 m -102.06 160.6 14.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 74.12 110.814 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 15.3 mm -141.14 140.79 31.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.118 -0.492 . . . . 74.12 111.135 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 16.2 mtm -143.8 132.45 22.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.087 -0.506 . . . . 73.43 110.889 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 35.8 m-20 -82.65 -169.72 2.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 64.13 110.871 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -61.44 2.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 74.35 110.87 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -51.63 -57.47 9.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.406 . . . . 75.02 110.872 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -50.54 -57.08 8.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 73.14 110.94 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.0 t -55.08 -40.06 69.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.495 . . . . 73.11 110.871 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.44 -45.62 88.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.129 -0.487 . . . . 72.14 110.877 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.22 -59.98 3.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 74.22 111.096 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -53.32 -48.51 68.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.267 -0.424 . . . . 75.51 110.832 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.28 -48.48 79.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 72.25 110.886 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.2 -41.51 62.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 64.21 111.137 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -70.28 -66.67 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 74.14 110.854 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.0 m -47.5 -35.79 4.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.275 -0.42 . . . . 74.13 111.148 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -69.43 -54.48 14.17 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.188 -0.46 . . . . 73.22 110.858 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.16 -52.25 27.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 72.22 111.116 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.32 -48.61 77.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.204 -0.453 . . . . 75.13 110.88 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.8 -36.49 37.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 73.13 110.856 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.58 -53.75 9.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.462 . . . . 75.13 111.116 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.34 -25.73 64.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 54.3 110.84 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 16.3 m -97.48 -16.24 7.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.467 . . . . 72.52 111.092 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.23 -0.441 . . . . 74.43 110.899 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 10.8 m . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.768 0.318 . . . . 73.32 111.169 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -105.24 159.44 29.4 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.559 0.695 . . . . 64.23 111.105 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 -7.37 20.9 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.686 2.258 . . . . 72.52 112.369 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -92.26 -38.72 11.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.434 . . . . 71.53 110.832 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -57.58 -61.36 2.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 71.33 110.898 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -45.15 -67.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 74.21 111.183 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.8 m -48.88 -39.33 11.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 75.25 111.098 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 23.1 mtmt -61.14 -45.04 96.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 75.23 110.864 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 75.8 t -61.81 -39.05 82.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.234 -0.439 . . . . 74.5 111.118 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.37 -58.71 5.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 72.44 110.924 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -24.91 67.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 74.11 110.937 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 18.5 ttmt -68.23 -52.02 38.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.184 -0.462 . . . . 71.23 110.898 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.5 mt -91.82 12.53 21.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 75.3 110.898 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.1 t 53.74 37.48 26.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 64.43 110.898 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -79.69 87.31 5.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 74.32 110.922 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.73 156.38 0.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 70.51 111.129 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.14 -21.15 58.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 75.24 110.899 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -50.13 10.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.254 -0.43 . . . . 75.15 110.873 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.95 -53.0 53.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 72.55 110.84 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -52.19 -33.66 41.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.135 -0.484 . . . . 73.15 111.072 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 23.1 t -79.56 -36.61 38.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 64.13 110.837 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -72.95 -24.38 60.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.112 -0.495 . . . . 73.53 110.939 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 51.4 mt -101.81 -63.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 75.43 111.095 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -74.34 -60.68 2.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 75.43 110.826 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 110.26 49.37 0.72 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.701 -0.762 . . . . 63.14 112.438 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.88 -36.91 31.03 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.764 -0.731 . . . . 41.52 112.501 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 102.82 165.08 26.03 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.771 -0.728 . . . . 74.32 112.522 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.8 p -50.93 -50.89 22.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.89 0.376 . . . . 63.43 111.12 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.87 38.46 0.8 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.487 . . . . 71.14 110.89 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.85 -76.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 74.33 111.097 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -43.02 -40.37 3.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 75.24 110.877 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.1 m -59.98 -75.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.145 -0.479 . . . . 74.31 110.857 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 32.5 mtt180 -50.03 -45.72 52.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.094 -0.503 . . . . 75.44 110.873 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -55.41 -37.31 67.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.24 -0.436 . . . . 73.52 110.852 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -51.3 -30.11 17.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 74.53 110.928 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -106.96 -22.11 12.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.478 . . . . 74.44 110.889 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.69 26.75 9.57 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.784 -0.722 . . . . 73.05 112.539 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -98.06 -4.7 35.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.822 0.344 . . . . 71.42 110.83 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -112.11 8.7 20.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 43.5 111.041 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.492 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -124.73 57.44 15.09 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.563 0.697 . . . . 71.15 110.855 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.506 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.9 Cg_endo -69.78 36.32 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.646 2.231 . . . . 75.43 112.342 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.772 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.5 t-160 73.93 32.28 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.522 0.677 . . . . 74.34 110.846 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.772 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 52.8 Cg_endo -69.86 -163.84 0.12 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.638 2.225 . . . . 74.13 112.316 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.44 -30.26 23.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.251 -0.432 . . . . 63.14 110.845 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 21.1 m -53.34 -50.57 64.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.138 -0.483 . . . . 73.42 111.141 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 41.0 mm -51.31 -42.36 26.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 75.11 111.136 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.17 -29.63 68.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.166 -0.47 . . . . 73.22 110.914 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.7 mp -79.25 -42.1 26.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 74.04 110.941 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.462 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 17.0 mt -63.93 -48.93 74.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 73.2 110.909 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 15.9 ptp180 -52.2 -34.81 47.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 72.2 110.882 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 30.9 m -93.88 -13.91 8.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.475 . . . . 74.33 111.144 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.462 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.4 OUTLIER -77.14 -40.29 46.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 72.21 110.9 179.954 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -50.0 -31.23 12.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.187 -0.461 . . . . 72.41 110.822 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.35 -20.86 18.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 74.04 110.868 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 53.7 m-70 -128.55 88.59 51.87 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.565 0.698 . . . . 63.5 110.835 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 3.4 2.76 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.646 2.231 . . . . 63.34 112.367 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -117.83 -11.98 10.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.43 . . . . 74.54 110.912 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.5 tp -53.54 -47.99 69.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.199 -0.455 . . . . 73.41 110.976 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -46.32 -32.77 3.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.467 . . . . 64.0 110.871 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -81.87 -38.1 25.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.17 -0.468 . . . . 73.41 110.907 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.74 -6.18 55.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.458 . . . . 74.2 110.89 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 7.9 pt -119.17 -20.41 4.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 75.14 111.119 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 73.22 110.892 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mtt . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.885 0.374 . . . . 71.03 110.88 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.02 -169.43 0.4 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 75.44 110.947 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.7 t -178.91 60.12 0.12 Allowed Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.588 0.709 . . . . 74.45 110.876 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -0.1 6.46 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 122.715 2.277 . . . . 74.04 112.324 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.8 m -87.52 -43.96 15.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.268 -0.424 . . . . 73.21 111.153 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.419 ' O ' ' HB2' ' A' ' 7' ' ' HIS . 0.0 OUTLIER -127.17 -30.8 2.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.474 . . . . 74.21 110.913 179.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.419 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 22.1 m-70 69.79 68.91 0.23 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 72.33 110.897 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -132.52 -71.72 0.53 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 75.22 110.994 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.34 -129.99 6.84 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.71 -0.757 . . . . 73.12 112.482 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -161.2 87.89 0.73 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.799 0.333 . . . . 72.33 110.88 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.53 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -50.64 105.04 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.146 -0.479 . . . . 75.52 110.874 179.951 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.0 p -142.58 126.93 15.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 74.24 111.132 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.51 129.28 18.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 73.31 110.791 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.406 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 179.98 81.46 0.06 OUTLIER Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.72 -0.753 . . . . 74.04 112.46 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.406 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -37.02 146.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.912 0.386 . . . . 74.44 111.088 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.91 -165.4 1.62 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.12 -0.491 . . . . 73.34 110.854 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.48 117.15 29.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 75.12 110.792 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.0 mm -107.88 91.53 7.77 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.623 0.725 . . . . 74.22 111.203 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 96.48 0.59 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.678 2.252 . . . . 72.51 112.343 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -61.15 -40.04 92.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 75.53 110.944 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.7 m -126.72 145.18 50.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.126 -0.488 . . . . 63.33 111.17 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -134.02 45.54 2.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 73.4 110.857 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.09 -68.4 0.63 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 75.55 110.911 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -136.08 -46.35 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.704 -0.76 . . . . 64.21 112.475 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.38 39.84 1.09 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.912 0.387 . . . . 74.34 110.918 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -52.67 115.23 1.7 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.079 -0.51 . . . . 73.32 110.907 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 t -127.76 93.81 3.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 73.42 111.118 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 43.7 t -77.69 126.42 38.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 73.31 111.133 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.402 ' O ' ' C ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -84.61 51.42 2.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 73.25 110.923 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.402 ' C ' ' O ' ' A' ' 29' ' ' LEU . 23.1 mttp -38.06 108.03 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 75.42 110.866 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.86 46.66 0.42 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.681 -0.771 . . . . 73.35 112.46 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 14.9 mm -107.61 91.22 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.838 0.352 . . . . 74.32 111.104 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.01 154.29 39.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.209 -0.451 . . . . 61.35 110.827 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.99 -108.57 0.31 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.709 -0.757 . . . . 62.31 112.491 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.53 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 49.9 mt -157.11 86.12 0.96 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.847 0.356 . . . . 73.12 110.874 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -160.02 161.08 33.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.151 -0.477 . . . . 74.34 110.905 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.6 t -169.58 -38.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.109 -0.496 . . . . 73.4 110.853 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.6 m -125.79 -47.18 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 75.2 111.153 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.88 170.43 10.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 71.53 110.892 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.9 t -137.4 15.91 2.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 74.13 110.863 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -104.82 -62.99 1.26 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 73.43 110.876 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -77.15 61.93 2.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 65.02 110.897 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.6 p -97.09 154.21 17.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.088 -0.505 . . . . 74.12 110.891 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 20.1 mm -141.25 139.77 32.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 74.12 111.158 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.8 mtt -142.88 139.68 30.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.425 . . . . 73.43 110.852 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 41.1 m-20 -87.59 -169.94 2.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 64.13 110.885 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -61.03 2.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.191 -0.459 . . . . 74.35 110.843 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.48 -57.44 9.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 75.02 110.979 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.02 -58.15 6.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.031 -0.531 . . . . 73.14 110.84 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.5 t -53.49 -42.38 67.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 73.11 110.926 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.59 -44.0 85.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.093 -0.503 . . . . 72.14 110.936 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.77 -61.82 1.95 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 74.22 111.106 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -52.6 -46.7 67.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.455 . . . . 75.51 110.859 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.41 -49.03 75.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.499 . . . . 72.25 110.91 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.94 -42.66 63.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.474 . . . . 64.21 111.135 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -69.65 -66.54 0.57 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 74.14 110.884 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.3 m -47.24 -35.72 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 74.13 111.143 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.7 mmmt -69.07 -54.89 12.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 73.22 110.883 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.07 -53.58 19.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.246 -0.434 . . . . 72.22 111.063 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.88 -49.27 75.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.45 . . . . 75.13 110.868 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.74 -36.31 25.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 73.13 110.823 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.65 -54.04 9.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.265 -0.425 . . . . 75.13 111.158 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.21 -28.27 64.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 54.3 110.884 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 23.2 m -94.9 -17.29 7.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.095 -0.502 . . . . 72.52 111.166 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 74.43 110.862 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 7.1 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.777 0.322 . . . . 73.32 111.144 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -106.8 159.95 28.06 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.617 0.722 . . . . 64.23 111.104 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.86 -7.48 21.2 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.658 2.239 . . . . 72.52 112.312 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -93.92 -37.44 11.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 71.53 110.856 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -57.76 -61.58 2.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.188 -0.46 . . . . 71.33 110.896 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -44.92 -67.33 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.154 -0.476 . . . . 74.21 111.106 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -48.88 -39.49 11.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 75.25 111.09 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 22.5 mtmt -60.6 -46.17 91.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.459 . . . . 75.23 110.873 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 73.4 t -60.92 -39.3 81.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 74.5 111.094 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.91 -60.73 2.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.181 -0.463 . . . . 72.44 110.848 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -22.91 66.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 74.11 110.832 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -68.94 -54.04 17.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 71.23 110.884 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.2 mt -91.52 14.69 14.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.24 -0.436 . . . . 75.3 110.909 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 11.0 m 53.19 39.47 29.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 64.43 110.838 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.69 88.17 5.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 74.32 110.958 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -46.73 156.87 0.17 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 70.51 111.197 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -59.67 -19.79 51.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 75.24 110.916 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 33.2 mmtt -82.45 -52.45 6.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.194 -0.457 . . . . 75.15 110.873 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -61.75 -51.78 66.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 72.55 110.844 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.44 -34.2 56.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 73.15 111.101 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.4 t -80.14 -31.1 39.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.245 -0.434 . . . . 64.13 110.906 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -77.84 -25.64 48.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.097 -0.502 . . . . 73.53 110.838 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 47.7 mt -101.23 -59.73 3.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 75.43 111.121 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -77.3 -61.12 2.09 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 75.43 110.898 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.78 50.07 0.71 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.767 -0.73 . . . . 63.14 112.486 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -78.77 -38.62 23.25 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 41.52 112.474 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 104.79 166.41 24.28 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.738 -0.744 . . . . 74.32 112.471 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.9 p -51.76 -50.66 31.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.892 0.377 . . . . 63.43 111.101 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -86.91 38.65 0.81 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 71.14 110.917 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.19 -76.46 0.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 74.33 111.08 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -43.33 -40.45 3.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.218 -0.446 . . . . 75.24 110.891 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.8 m -60.09 -75.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 74.31 110.874 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 30.9 mtt180 -49.84 -45.82 50.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 75.44 110.918 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -55.65 -37.28 68.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.197 -0.456 . . . . 73.52 110.904 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -51.83 -29.69 20.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.493 . . . . 74.53 110.856 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.8 -22.29 12.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 74.44 110.94 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.65 26.9 9.45 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.782 -0.723 . . . . 73.05 112.504 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -98.19 -5.85 32.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.857 0.361 . . . . 71.42 110.889 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -110.83 9.22 22.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.136 -0.484 . . . . 43.5 111.07 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.493 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -125.07 57.35 15.83 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.604 0.716 . . . . 71.15 110.835 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.508 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.0 Cg_endo -69.8 36.08 0.23 Allowed 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.656 2.238 . . . . 75.43 112.394 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.777 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 1.7 t-80 74.1 31.99 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.547 0.689 . . . . 74.34 110.849 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.777 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.6 Cg_endo -69.74 -163.83 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.71 2.273 . . . . 74.13 112.324 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 20.2 m -85.67 -29.58 23.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.445 . . . . 63.14 110.884 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 22.0 m -53.7 -50.84 65.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.113 -0.494 . . . . 73.42 111.14 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 39.3 mm -51.06 -42.61 24.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.249 -0.432 . . . . 75.11 111.094 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.08 -29.84 68.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 73.22 110.89 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.5 mp -78.82 -42.2 28.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.242 -0.435 . . . . 74.04 110.912 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.461 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 16.3 mt -64.06 -48.8 74.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 73.2 110.954 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -52.77 -34.63 54.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 72.2 110.918 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 29.3 m -93.66 -13.95 8.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 74.33 111.114 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.5 OUTLIER -77.62 -40.2 42.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.111 -0.495 . . . . 72.21 110.899 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -50.03 -31.1 12.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 72.41 110.852 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.51 -20.63 18.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.134 -0.485 . . . . 74.04 110.929 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 50.3 m-70 -129.01 89.56 48.29 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.643 0.735 . . . . 63.5 110.854 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.72 1.05 4.76 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.703 2.269 . . . . 63.34 112.334 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -114.53 -12.51 12.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 74.54 110.932 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.8 tp -53.85 -47.76 70.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.082 -0.508 . . . . 73.41 110.979 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.422 ' HA ' HG12 ' A' ' 130' ' ' ILE . 2.6 pt? -50.5 -29.21 9.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 64.0 110.955 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . 0.454 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.59 -26.68 24.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.183 -0.462 . . . . 73.41 110.873 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -95.52 4.1 53.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.446 . . . . 74.2 110.917 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . 0.422 HG12 ' HA ' ' A' ' 127' ' ' LEU . 12.3 pt -123.16 -34.7 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 75.14 111.121 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.454 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 2.8 ptt-85 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 73.22 110.902 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 mmt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.864 0.364 . . . . 71.03 110.85 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.67 -168.81 0.39 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.272 -0.422 . . . . 75.44 110.877 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 p -179.45 61.18 0.12 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.579 0.704 . . . . 74.45 110.847 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.73 -5.41 16.12 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.706 2.271 . . . . 74.04 112.319 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.7 t -72.0 -60.52 2.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 73.21 111.132 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.23 -17.91 6.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 74.21 110.906 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 63.85 72.57 0.46 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 72.33 110.87 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -131.29 -75.55 0.52 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.146 -0.479 . . . . 75.22 110.934 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -94.3 -117.22 2.85 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.727 -0.749 . . . . 73.12 112.515 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -170.84 93.94 0.19 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.86 0.362 . . . . 72.33 110.891 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.512 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -59.23 103.06 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.466 . . . . 75.52 110.852 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.7 p -144.28 129.32 14.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.282 -0.417 . . . . 74.24 111.169 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.9 p -48.31 131.8 16.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.147 -0.479 . . . . 73.31 110.813 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.42 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.98 79.72 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.748 -0.739 . . . . 74.04 112.46 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.42 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.0 144.85 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.913 0.387 . . . . 74.44 111.115 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.08 -165.61 1.76 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.475 . . . . 73.34 110.889 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -94.62 116.91 29.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 75.12 110.911 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.9 mm -108.83 90.76 7.99 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.652 0.739 . . . . 74.22 111.134 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 96.93 0.61 Allowed 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.72 2.28 . . . . 72.51 112.332 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -64.98 -36.41 84.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.294 -0.412 . . . . 75.53 110.861 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.465 ' HB ' ' HA ' ' A' ' 26' ' ' LYS . 58.7 m -128.2 151.64 49.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 63.33 111.162 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -152.27 41.69 0.64 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.438 . . . . 73.4 110.908 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.56 -39.61 1.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.132 -0.485 . . . . 75.55 110.887 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -158.53 -45.14 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.76 -0.734 . . . . 64.21 112.545 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.71 44.8 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.892 0.377 . . . . 74.34 110.915 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.465 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 0.5 OUTLIER -51.75 118.66 3.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 73.32 110.908 179.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.8 t -132.91 92.36 3.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.233 -0.439 . . . . 73.42 111.12 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.1 t -76.84 128.95 37.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 73.31 111.062 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.407 ' O ' ' C ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -84.44 52.14 2.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 73.25 110.951 179.937 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.407 ' C ' ' O ' ' A' ' 29' ' ' LEU . 32.4 mttp -36.89 107.38 0.06 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 75.42 110.908 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.05 50.15 0.4 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.715 -0.755 . . . . 73.35 112.55 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.3 mm -108.89 93.14 2.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.836 0.351 . . . . 74.32 111.152 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -76.24 152.92 36.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.464 . . . . 61.35 110.817 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.96 -108.47 0.31 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.717 -0.754 . . . . 62.31 112.479 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.512 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 56.0 mt -156.92 85.98 0.97 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.816 0.341 . . . . 73.12 110.956 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -160.23 160.57 32.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 74.34 110.926 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.3 t -162.78 -41.0 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 73.4 110.885 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.3 m -127.99 -47.38 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.212 -0.449 . . . . 75.2 111.149 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -85.9 170.0 12.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.134 -0.484 . . . . 71.53 110.883 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -136.43 8.47 3.13 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.241 -0.436 . . . . 74.13 110.928 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -97.84 -63.45 1.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 73.43 110.896 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -77.03 60.96 1.91 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 65.02 110.922 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.2 p -99.65 161.98 13.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 74.12 110.816 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 23.2 mm -144.22 140.21 24.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.091 -0.504 . . . . 74.12 111.055 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.6 mtm -144.89 129.98 18.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.138 -0.483 . . . . 73.43 110.92 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.7 m-20 -83.38 -169.79 2.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 64.13 110.877 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.62 -57.8 10.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 74.35 110.877 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -56.16 22.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.439 . . . . 75.02 110.905 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.64 -60.1 3.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.12 -0.491 . . . . 73.14 110.973 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.3 t -54.2 -39.38 66.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 73.11 110.834 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.44 -45.88 87.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.097 -0.501 . . . . 72.14 110.924 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.74 -59.29 4.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 74.22 111.1 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -53.42 -48.37 68.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.226 -0.443 . . . . 75.51 110.861 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.93 -48.66 77.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 72.25 110.834 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.16 -41.28 62.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.288 -0.414 . . . . 64.21 111.109 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -70.6 -66.81 0.56 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.175 -0.466 . . . . 74.14 110.893 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 13.5 m -47.28 -36.38 4.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.247 -0.433 . . . . 74.13 111.078 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -69.35 -52.94 22.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 73.22 110.865 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.56 -49.84 55.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.445 . . . . 72.22 111.122 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -65.86 -49.26 68.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.285 -0.416 . . . . 75.13 110.816 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -48.98 -44.03 40.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 73.13 110.834 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.88 -56.45 7.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 75.13 111.081 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -50.43 -43.3 54.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 54.3 110.882 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.0 p -77.84 -24.48 14.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.113 -0.494 . . . . 72.52 111.143 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.179 -0.464 . . . . 74.43 110.893 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 4.7 m . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.793 0.33 . . . . 73.32 111.144 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -104.56 159.59 28.82 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.598 0.713 . . . . 64.23 111.143 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 -6.86 19.61 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.671 2.248 . . . . 72.52 112.385 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.93 -40.99 10.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 71.53 110.884 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -56.71 -61.13 2.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.476 . . . . 71.33 110.885 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -44.28 -68.87 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 74.21 111.176 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.1 m -48.73 -38.7 10.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.456 . . . . 75.25 111.109 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.1 mtmt -60.18 -40.17 89.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 75.23 110.845 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 82.3 t -69.58 -38.18 76.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 74.5 111.174 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -68.27 -35.39 77.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 72.44 110.882 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.0 pttt -88.06 -19.33 27.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.485 . . . . 74.11 110.923 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.74 -51.73 13.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.446 . . . . 71.23 110.899 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.8 mt -92.21 14.58 15.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.449 . . . . 75.3 110.842 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.3 m 50.58 43.45 27.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 64.43 110.825 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -78.68 86.21 4.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.129 -0.487 . . . . 74.32 110.909 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.91 156.04 0.16 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.203 -0.453 . . . . 70.51 111.049 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -57.73 -22.49 46.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 75.24 110.881 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -79.85 -52.31 8.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 75.15 110.814 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -62.67 -56.16 20.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.265 -0.425 . . . . 72.55 110.861 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -52.6 -34.32 50.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 73.15 111.127 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 91.9 p -80.95 -27.71 35.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.2 -0.454 . . . . 64.13 110.849 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -80.52 -26.66 37.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.48 . . . . 73.53 110.938 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 22.4 mm -101.29 -56.46 5.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.133 -0.485 . . . . 75.43 111.119 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -80.86 -62.93 1.52 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 75.43 110.933 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 110.95 52.38 0.57 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.692 -0.766 . . . . 63.14 112.469 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -80.71 -40.98 11.43 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.762 -0.733 . . . . 41.52 112.509 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 101.96 -179.87 27.55 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.746 -0.74 . . . . 74.32 112.513 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 5.3 p -67.08 -50.55 62.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.822 0.344 . . . . 63.43 111.167 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -86.24 31.9 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 71.14 110.937 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.63 -75.9 0.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 74.33 111.08 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -39.72 -47.34 2.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 75.24 110.87 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 40.2 t -56.92 -74.78 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 74.31 110.921 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 36.7 mtt180 -47.07 -54.48 10.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.124 -0.489 . . . . 75.44 110.87 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -49.83 -37.68 31.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.45 . . . . 73.52 110.863 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -55.43 -40.65 71.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 74.53 110.904 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.26 -17.34 26.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 74.44 110.871 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.96 25.7 18.99 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.768 -0.729 . . . . 73.05 112.498 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -93.46 -27.66 16.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.831 0.348 . . . . 71.42 110.816 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -100.61 18.7 18.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 43.5 111.083 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.528 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.1 tm0? -121.65 53.74 4.23 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.62 0.724 . . . . 71.15 110.889 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 54.0 Cg_endo -69.81 28.51 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.668 2.245 . . . . 75.43 112.347 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.718 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.9 m170 70.2 36.87 0.12 Allowed Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.577 0.703 . . . . 74.34 110.88 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.718 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.5 Cg_endo -69.71 -165.37 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.64 2.227 . . . . 74.13 112.405 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.0 p -83.05 -32.64 26.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.267 -0.424 . . . . 63.14 110.913 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 18.5 m -49.17 -43.48 42.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.144 -0.48 . . . . 73.42 111.167 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 24.7 mm -58.96 -44.4 90.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 75.11 111.082 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.47 -28.85 69.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.466 . . . . 73.22 110.89 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.5 mp -81.14 -42.52 20.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.266 -0.424 . . . . 74.04 110.978 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.43 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 18.2 mt -61.54 -49.28 77.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 73.2 110.852 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 15.7 ptp180 -52.11 -39.41 59.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 72.2 110.864 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 33.8 m -88.34 -13.4 9.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.226 -0.443 . . . . 74.33 111.128 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.4 OUTLIER -78.54 -39.88 36.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.162 -0.472 . . . . 72.21 110.923 179.979 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.16 -31.33 13.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 72.41 110.881 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.43 -19.49 18.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.151 -0.477 . . . . 74.04 110.963 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 46.5 m-70 -130.05 88.46 48.41 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.613 0.72 . . . . 63.5 110.867 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.83 2.74 3.3 Favored 'Trans proline' 0 C--N 1.342 0.231 0 C-N-CA 122.652 2.235 . . . . 63.34 112.311 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -116.83 -11.68 10.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.274 -0.421 . . . . 74.54 110.837 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.4 tp -53.85 -46.38 71.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 73.41 110.883 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.412 ' HA ' HG12 ' A' ' 130' ' ' ILE . 1.6 pt? -50.11 -29.24 8.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 64.0 110.869 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . 0.495 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.8 m-80 -86.57 -27.48 23.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 73.41 110.928 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -94.54 4.58 53.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.19 -0.459 . . . . 74.2 110.919 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . 0.412 HG12 ' HA ' ' A' ' 127' ' ' LEU . 12.0 pt -123.84 -35.1 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 75.14 111.146 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.495 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 73.22 110.936 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 mmt . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.836 0.351 . . . . 71.03 110.849 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.56 -169.49 0.44 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.246 -0.434 . . . . 75.44 110.893 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 1.7 p 178.7 55.67 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.385 0 CA-C-O 121.516 0.674 . . . . 74.45 110.899 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 53.4 Cg_endo -69.79 -8.67 24.2 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.709 2.272 . . . . 74.04 112.277 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.8 m -67.45 -49.56 70.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 73.21 111.132 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.2 m -133.19 -20.96 2.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.171 -0.468 . . . . 74.21 110.893 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 66.65 89.01 0.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.216 -0.447 . . . . 72.33 110.909 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.619 HE21 ' N ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -132.26 -65.85 0.72 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 75.22 110.94 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -129.55 -96.0 0.78 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.745 -0.74 . . . . 73.12 112.441 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -177.0 95.28 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.87 0.367 . . . . 72.33 110.86 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.54 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -62.45 102.94 0.36 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 75.52 110.909 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.7 p -144.28 129.22 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.28 -0.418 . . . . 74.24 111.166 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -48.65 130.28 17.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.154 -0.476 . . . . 73.31 110.861 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.421 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.66 80.71 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.752 -0.737 . . . . 74.04 112.487 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.421 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.3 146.21 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.851 0.358 . . . . 74.44 111.125 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.1 -165.49 1.73 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.123 -0.489 . . . . 73.34 110.914 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.62 117.76 31.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.265 -0.425 . . . . 75.12 110.846 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.4 mm -108.21 91.42 8.07 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.623 0.725 . . . . 74.22 111.13 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 96.76 0.6 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.662 2.241 . . . . 72.51 112.322 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -63.11 -37.69 88.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.198 -0.455 . . . . 75.53 110.882 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.0 m -127.55 146.97 50.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 63.33 111.153 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -142.86 38.5 1.47 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.46 . . . . 73.4 110.86 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.64 -40.42 1.4 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.192 -0.458 . . . . 75.55 110.854 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -156.41 -58.98 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.691 -0.766 . . . . 64.21 112.459 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.28 47.04 1.39 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.872 0.367 . . . . 74.34 110.926 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.8 tttm -54.61 113.35 1.27 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 73.32 110.936 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.8 t -127.13 92.68 3.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.241 -0.436 . . . . 73.42 111.092 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 44.3 t -77.06 126.87 38.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 73.31 111.133 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.41 ' O ' ' C ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -84.64 51.19 2.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 73.25 110.921 179.975 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.41 ' C ' ' O ' ' A' ' 29' ' ' LEU . 22.8 mttp -37.73 108.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.466 . . . . 75.42 110.851 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.48 47.02 0.43 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.716 -0.754 . . . . 73.35 112.473 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 15.5 mm -107.92 90.95 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.824 0.345 . . . . 74.32 111.168 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.54 153.97 40.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.195 -0.457 . . . . 61.35 110.865 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.46 -109.0 0.32 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.714 -0.755 . . . . 62.31 112.445 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.54 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 56.0 mt -156.79 86.29 0.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.857 0.36 . . . . 73.12 110.885 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -160.34 163.16 33.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 74.34 110.854 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.1 t -164.31 -39.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 73.4 110.967 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 15.7 m -131.1 -44.57 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.133 -0.485 . . . . 75.2 111.115 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.47 169.7 11.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 71.53 110.787 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 98.2 m -134.94 7.14 3.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.153 -0.476 . . . . 74.13 110.934 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -94.03 -65.07 1.01 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.176 -0.465 . . . . 73.43 110.895 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -76.21 61.29 1.59 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.133 -0.485 . . . . 65.02 110.929 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.9 p -100.13 158.4 15.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 74.12 110.902 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 20.6 mm -145.33 140.17 22.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 74.12 111.133 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.5 mtt -143.37 140.55 30.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 73.43 110.848 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 35.5 m-20 -88.54 -169.88 2.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 64.13 110.861 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -61.13 2.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.179 -0.464 . . . . 74.35 110.867 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.26 -57.29 9.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 75.02 110.846 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.04 -58.25 6.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 73.14 110.866 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.8 t -53.48 -42.2 67.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 73.11 110.844 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -57.46 -45.02 85.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.146 -0.479 . . . . 72.14 110.866 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.03 -61.71 2.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 74.22 111.114 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -52.6 -48.59 66.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 75.51 110.779 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -48.9 78.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.245 -0.434 . . . . 72.25 110.878 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.79 -43.27 62.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.236 -0.438 . . . . 64.21 111.128 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -68.76 -66.6 0.55 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 74.14 110.945 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.0 m -47.5 -36.71 4.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.13 -0.486 . . . . 74.13 111.113 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 mmmt -67.02 -55.96 12.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 73.22 110.906 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.29 -53.05 23.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 72.22 111.145 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.85 -48.53 78.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 75.13 110.965 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -50.25 -38.47 40.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.126 -0.488 . . . . 73.13 110.855 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.67 -53.67 12.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.139 -0.482 . . . . 75.13 111.103 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.1 -26.95 63.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.152 -0.477 . . . . 54.3 110.864 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.0 m -93.87 -19.56 6.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 72.52 111.109 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 74.43 110.887 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 16.8 m . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.855 0.359 . . . . 73.32 111.135 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -100.81 159.91 28.24 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.542 0.687 . . . . 64.23 111.132 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.7 -6.78 19.4 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.657 2.238 . . . . 72.52 112.339 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -92.34 -40.24 11.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.271 -0.422 . . . . 71.53 110.841 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -57.77 -60.75 3.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 71.33 110.85 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -44.18 -68.46 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.451 . . . . 74.21 111.126 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.3 m -49.03 -39.61 12.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 75.25 111.166 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.4 mtmt -59.42 -38.54 80.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 75.23 110.934 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 98.7 t -71.11 -39.22 73.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 74.5 111.089 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.5 -30.59 68.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 72.44 110.918 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.64 -22.31 21.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.853 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -74.14 -50.88 17.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 71.23 110.953 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.1 mt -90.64 12.68 18.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 75.3 110.865 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.43 43.01 29.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 64.43 110.853 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -78.69 86.28 4.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.125 -0.489 . . . . 74.32 110.91 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -46.11 156.75 0.14 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.16 -0.473 . . . . 70.51 111.103 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -59.89 -22.69 62.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 75.24 110.905 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.1 -51.06 10.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 75.15 110.887 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.48 -52.75 42.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 72.55 110.843 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.95 -32.01 61.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.113 -0.494 . . . . 73.15 111.103 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.4 t -80.44 -35.08 35.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 64.13 110.869 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -76.3 -23.37 54.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 73.53 110.878 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 57.1 mt -102.09 -60.68 2.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.142 -0.481 . . . . 75.43 111.16 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -78.51 -63.49 1.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.485 . . . . 75.43 110.903 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 111.32 47.17 0.76 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.8 -0.715 . . . . 63.14 112.466 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -69.21 -46.88 56.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.721 -0.752 . . . . 41.52 112.488 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 111.45 169.53 18.75 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.689 -0.767 . . . . 74.32 112.48 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -51.22 -66.6 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.912 0.387 . . . . 63.43 111.222 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -86.07 40.67 0.88 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.099 -0.5 . . . . 71.14 110.876 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.76 -73.6 0.1 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 74.33 111.095 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -40.28 -46.21 2.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.465 . . . . 75.24 110.912 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.3 m -56.46 -74.74 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.087 -0.506 . . . . 74.31 110.902 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 10.1 mtt85 -48.38 -52.79 20.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.08 -0.509 . . . . 75.44 110.867 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -50.76 -36.27 35.91 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.216 -0.447 . . . . 73.52 110.925 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -56.12 -39.7 72.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 74.53 110.862 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.74 -17.64 23.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 74.44 110.948 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.0 27.15 14.33 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.747 -0.74 . . . . 73.05 112.502 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.1 m-20 -96.38 -20.57 18.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.794 0.331 . . . . 71.42 110.911 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -108.54 17.35 22.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.09 -0.505 . . . . 43.5 111.151 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.516 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.4 tm0? -120.56 54.56 3.7 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.63 0.729 . . . . 71.15 110.935 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.429 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 54.1 Cg_endo -69.77 31.64 0.19 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.686 2.257 . . . . 75.43 112.361 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.696 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.0 m-70 69.02 38.46 0.18 Allowed Pre-proline 0 C--N 1.331 -0.237 0 CA-C-O 121.557 0.694 . . . . 74.34 110.854 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.696 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.5 Cg_endo -69.83 -165.71 0.16 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.619 2.212 . . . . 74.13 112.354 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 12.0 m -83.65 -33.54 25.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.237 -0.438 . . . . 63.14 110.904 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 15.5 m -48.87 -40.79 31.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.107 -0.497 . . . . 73.42 111.174 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 27.2 mm -61.08 -43.8 96.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 75.11 111.183 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.08 -28.91 69.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.084 -0.507 . . . . 73.22 110.843 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.5 mp -81.46 -42.98 19.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.231 -0.441 . . . . 74.04 110.911 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.439 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 30.2 mt -62.02 -49.36 76.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.185 -0.461 . . . . 73.2 110.856 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -51.61 -38.48 54.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 72.2 110.886 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 33.3 m -89.68 -13.99 9.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.169 -0.469 . . . . 74.33 111.134 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.439 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.3 OUTLIER -77.62 -40.82 40.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 72.21 110.89 -179.993 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -49.32 -31.98 10.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.199 -0.455 . . . . 72.41 110.926 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.46 -21.2 17.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.147 -0.479 . . . . 74.04 110.884 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 31.8 m-70 -127.56 88.21 54.2 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.606 0.717 . . . . 63.5 110.871 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 3.53 2.71 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.716 2.277 . . . . 63.34 112.37 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -117.24 -12.69 10.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 74.54 110.937 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.11 -46.79 72.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 73.41 110.954 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.41 ' O ' ' HB3' ' A' ' 131' ' ' ARG . 1.7 pt? -49.41 -29.68 6.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.489 . . . . 64.0 110.903 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . 0.477 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.27 -28.6 23.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 73.41 110.886 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.18 4.68 53.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.45 . . . . 74.2 110.91 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 12.1 pt -123.81 -35.01 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 75.14 111.14 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.477 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 2.1 ptt-85 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 73.22 110.841 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mmt . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.835 0.35 . . . . 71.03 110.871 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.82 -169.39 0.41 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 75.44 110.846 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.9 p 175.92 58.66 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.614 0.721 . . . . 74.45 110.924 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 1.15 4.67 Favored 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.698 2.265 . . . . 74.04 112.349 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.6 m -89.59 -41.97 14.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 73.21 111.213 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -125.45 -31.37 3.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.152 -0.476 . . . . 74.21 110.896 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 66.6 53.42 0.93 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 72.33 110.85 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 85.7 mm-40 -112.38 -76.08 0.6 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.247 -0.433 . . . . 75.22 110.882 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.91 -109.47 3.27 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.702 -0.761 . . . . 73.12 112.449 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -177.46 98.3 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.888 0.375 . . . . 72.33 110.87 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.54 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -55.72 106.56 0.26 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.09 -0.505 . . . . 75.52 110.873 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.1 p -149.16 130.67 5.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 74.24 111.161 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -45.93 127.98 8.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.433 . . . . 73.31 110.893 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.97 79.79 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.707 -0.758 . . . . 74.04 112.491 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -36.97 146.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.881 0.372 . . . . 74.44 111.092 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.58 -168.28 2.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.187 -0.46 . . . . 73.34 110.909 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -93.98 116.21 28.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 75.12 110.889 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' A' ' 28' ' ' VAL . 8.2 mm -107.98 90.66 6.8 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.572 0.701 . . . . 74.22 111.157 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.452 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.75 104.19 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.657 2.238 . . . . 72.51 112.383 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -70.87 -30.97 67.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 75.53 110.926 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 21.6 m -128.21 147.44 50.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 63.33 111.167 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -146.35 30.49 1.02 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 73.4 110.884 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.63 -44.81 2.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.116 -0.493 . . . . 75.55 110.878 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -151.22 -58.08 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.774 -0.727 . . . . 64.21 112.473 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.73 45.46 1.23 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.381 . . . . 74.34 110.869 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.1 tttm -49.66 110.85 0.42 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 73.32 110.872 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.2 t -132.13 93.28 3.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 73.42 111.131 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.452 ' HA ' ' HA ' ' A' ' 19' ' ' PRO . 0.8 OUTLIER -80.82 139.83 17.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 73.31 111.13 179.924 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.428 ' HG ' ' HB2' ' A' ' 56' ' ' GLN . 0.2 OUTLIER -86.09 63.6 8.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 73.25 110.921 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.0 mttp -42.26 104.55 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 75.42 110.918 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.42 60.49 0.3 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.759 -0.734 . . . . 73.35 112.495 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.421 HG12 ' O ' ' A' ' 29' ' ' LEU . 18.2 mm -116.78 92.34 2.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.807 0.337 . . . . 74.32 111.135 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.52 156.66 36.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.274 -0.421 . . . . 61.35 110.828 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 164.53 -107.66 0.31 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.713 -0.755 . . . . 62.31 112.464 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.54 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 49.8 mt -156.47 83.33 0.98 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.91 0.385 . . . . 73.12 110.916 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.428 ' CD1' ' N ' ' A' ' 36' ' ' TYR . 0.1 OUTLIER -165.66 168.79 15.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 74.34 110.935 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.1 t -177.06 -35.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 73.4 110.879 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.69 -49.01 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 75.2 111.134 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.79 173.93 7.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 71.53 110.786 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.8 p -147.8 36.3 0.86 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 74.13 110.843 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -112.36 -75.67 0.6 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 73.43 110.913 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -79.06 60.4 2.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 65.02 110.912 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.2 p -83.73 159.48 21.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.463 . . . . 74.12 110.837 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 28.4 mm -142.76 140.65 27.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.056 -0.52 . . . . 74.12 111.123 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.1 mtt -145.66 141.16 27.85 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 73.43 110.88 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.0 m-20 -86.07 -169.93 2.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 64.13 110.908 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 6.6 mmpt? -57.8 -59.62 4.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 74.35 110.878 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.93 -57.76 8.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.26 -0.427 . . . . 75.02 110.925 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.58 -59.03 4.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.19 -0.459 . . . . 73.14 110.882 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.6 t -52.79 -38.22 60.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.134 -0.485 . . . . 73.11 110.871 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.54 -43.24 99.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.096 -0.502 . . . . 72.14 110.902 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.89 -58.78 5.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 74.22 111.073 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -53.63 -47.64 70.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.251 -0.431 . . . . 75.51 110.937 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -50.98 67.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.117 -0.492 . . . . 72.25 110.877 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.02 -40.57 58.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 64.21 111.071 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.428 ' HB2' ' HG ' ' A' ' 29' ' ' LEU . 3.4 mt-30 -70.29 -67.48 0.49 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 74.14 110.876 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 9.3 m -48.01 -34.58 4.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.227 -0.442 . . . . 74.13 111.13 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.3 mmmm -69.19 -56.71 6.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 73.22 110.882 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -48.99 -51.89 28.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.248 -0.433 . . . . 72.22 111.07 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.83 -48.66 78.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.263 -0.426 . . . . 75.13 110.853 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.54 -37.57 40.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.494 . . . . 73.13 110.866 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.0 -52.82 15.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 75.13 111.133 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.46 -31.31 67.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 54.3 110.791 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.9 m -91.45 -16.54 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 72.52 111.087 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 74.43 110.833 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 14.7 m . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.814 0.34 . . . . 73.32 111.166 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -106.71 159.39 30.03 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.535 0.684 . . . . 64.23 111.124 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -7.81 22.01 Favored 'Trans proline' 0 C--N 1.341 0.132 0 C-N-CA 122.681 2.254 . . . . 72.52 112.367 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -95.77 -38.36 10.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.23 -0.441 . . . . 71.53 110.917 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -55.71 -61.6 2.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.126 -0.488 . . . . 71.33 110.859 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -44.42 -68.68 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.165 -0.47 . . . . 74.21 111.094 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.6 m -48.88 -39.03 11.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 75.25 111.149 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -60.82 -38.52 85.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 75.23 110.966 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 97.3 t -70.63 -38.29 72.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.455 . . . . 74.5 111.111 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 78' ' ' ARG . 1.1 mtp180 -69.58 -32.63 71.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 72.44 110.85 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.57 -18.97 24.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 74.11 110.877 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -76.1 -51.46 12.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.276 -0.42 . . . . 71.23 110.916 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.5 mt -91.39 14.44 14.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 75.3 110.905 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.49 42.91 29.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.464 . . . . 64.43 110.904 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -78.71 84.36 4.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 74.32 110.895 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.78 155.92 0.23 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 70.51 111.177 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -57.82 -22.52 47.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 75.24 110.936 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.17 -53.31 7.1 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.174 -0.467 . . . . 75.15 110.869 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.42 -55.68 19.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 72.55 110.936 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.22 -35.9 39.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 73.15 111.094 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 94.5 p -78.61 -32.24 47.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 64.13 110.82 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -74.62 -28.52 60.92 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.123 -0.49 . . . . 73.53 110.906 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 17.3 mm -99.9 -61.75 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 75.43 111.11 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -73.42 -63.46 1.19 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 75.43 110.882 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 117.51 37.94 0.88 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.765 -0.731 . . . . 63.14 112.549 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -57.54 -52.18 53.41 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.782 -0.723 . . . . 41.52 112.463 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.11 -154.49 16.62 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.698 -0.763 . . . . 74.32 112.556 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.6 t -85.14 -67.2 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.882 0.372 . . . . 63.43 111.065 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -82.11 36.18 0.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.443 . . . . 71.14 110.923 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.38 -78.77 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.5 . . . . 74.33 111.076 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -38.09 -43.05 0.71 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 75.24 110.913 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.2 t -57.39 -76.6 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 74.31 110.929 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -50.06 -48.97 52.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.481 . . . . 75.44 110.861 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -52.22 -36.33 51.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.144 -0.48 . . . . 73.52 110.911 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -55.73 -31.67 62.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.065 -0.516 . . . . 74.53 110.876 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.44 -17.21 15.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 74.44 110.899 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.18 26.65 15.44 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.773 -0.727 . . . . 73.05 112.517 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -99.04 -2.82 36.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.848 0.356 . . . . 71.42 110.839 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.95 17.09 10.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 43.5 111.139 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.461 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -126.34 55.21 13.0 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.535 0.684 . . . . 71.15 110.871 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.476 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.9 Cg_endo -69.74 39.09 0.27 Allowed 'Trans proline' 0 C--N 1.341 0.135 0 C-N-CA 122.619 2.213 . . . . 75.43 112.424 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.734 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.3 m170 70.96 35.31 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.618 0.723 . . . . 74.34 110.861 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.734 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.5 Cg_endo -69.69 -164.15 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.765 2.31 . . . . 74.13 112.348 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.29 -27.27 22.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 63.14 110.844 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 48.1 m -58.74 -41.28 86.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.078 -0.51 . . . . 73.42 111.161 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 46.3 mm -61.76 -46.31 96.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 75.11 111.13 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.45 -29.05 69.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.136 -0.484 . . . . 73.22 110.911 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.407 ' HG ' HD12 ' A' ' 130' ' ' ILE . 5.7 mp -79.64 -42.35 25.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.192 -0.458 . . . . 74.04 110.845 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.455 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 26.9 mt -62.97 -48.57 78.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 73.2 110.931 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 15.3 ptp180 -53.05 -35.2 59.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 72.2 110.884 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 30.6 m -93.45 -12.8 8.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 74.33 111.066 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.455 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.5 OUTLIER -79.02 -39.21 34.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 72.21 110.897 -179.989 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.61 -30.39 13.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.244 -0.435 . . . . 72.41 110.801 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.15 -19.42 17.92 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.204 -0.453 . . . . 74.04 110.89 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 46.5 m-70 -130.27 88.29 48.28 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.544 0.687 . . . . 63.5 110.837 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.69 2.57 3.37 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.724 2.283 . . . . 63.34 112.351 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -116.81 -11.52 10.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.225 -0.443 . . . . 74.54 110.925 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.5 tp -53.87 -46.32 71.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.108 -0.496 . . . . 73.41 110.884 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.415 ' HA ' HG12 ' A' ' 130' ' ' ILE . 1.7 pt? -49.97 -29.65 8.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.471 . . . . 64.0 110.922 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . 0.49 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.34 -27.8 24.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.448 . . . . 73.41 110.878 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.59 3.69 55.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.185 -0.461 . . . . 74.2 110.914 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . 0.415 HG12 ' HA ' ' A' ' 127' ' ' LEU . 13.7 pt -122.6 -34.82 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.496 . . . . 75.14 111.124 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.49 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 73.22 110.833 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.9 mmt . . . . . 0 N--CA 1.458 -0.063 0 CA-C-O 120.841 0.353 . . . . 71.03 110.88 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.7 -169.31 0.42 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 75.44 110.915 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 p 176.73 58.26 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.636 0.731 . . . . 74.45 110.91 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.82 3.66 2.67 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.653 2.235 . . . . 74.04 112.247 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.5 m -95.05 -42.46 12.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.293 -0.412 . . . . 73.21 111.131 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.62 -32.53 3.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 74.21 110.835 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.8 m-70 65.37 49.94 1.81 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.466 . . . . 72.33 110.828 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -111.18 -75.24 0.62 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.442 . . . . 75.22 110.819 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -102.08 -109.51 3.28 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.768 -0.729 . . . . 73.12 112.444 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -177.29 98.16 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.852 0.358 . . . . 72.33 110.854 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.544 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -55.78 105.85 0.21 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 75.52 110.845 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.1 p -148.28 129.93 6.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.169 -0.469 . . . . 74.24 111.141 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -45.69 125.28 5.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 73.31 110.891 -179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -178.0 81.83 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.774 -0.727 . . . . 74.04 112.564 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -38.15 148.65 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.873 0.368 . . . . 74.44 111.12 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.41 -164.84 1.44 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.189 -0.459 . . . . 73.34 110.907 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.2 116.75 29.97 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.243 -0.435 . . . . 75.12 110.867 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.2 mm -107.65 91.83 7.85 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.671 0.748 . . . . 74.22 111.086 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 96.08 0.58 Allowed 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.693 2.262 . . . . 72.51 112.305 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -60.76 -39.63 89.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.187 -0.461 . . . . 75.53 110.945 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.7 m -128.41 144.69 51.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.134 -0.484 . . . . 63.33 111.064 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -134.13 45.81 2.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 73.4 110.864 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.57 -68.28 0.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 75.55 110.874 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.83 -46.62 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.712 -0.756 . . . . 64.21 112.513 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.25 39.71 1.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.86 0.362 . . . . 74.34 110.891 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -52.51 118.92 3.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.161 -0.472 . . . . 73.32 110.909 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 t -132.55 93.31 3.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.254 -0.43 . . . . 73.42 111.15 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 42.9 t -77.45 126.2 37.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 73.31 111.105 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.33 51.77 2.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.108 -0.496 . . . . 73.25 110.89 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -38.83 107.03 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 75.42 110.937 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.8 45.07 0.39 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.713 -0.756 . . . . 73.35 112.465 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 14.2 mm -106.28 91.0 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.862 0.363 . . . . 74.32 111.118 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.09 158.23 34.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.103 -0.499 . . . . 61.35 110.878 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 164.81 -106.86 0.28 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.762 -0.733 . . . . 62.31 112.497 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.544 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 45.6 mt -156.68 82.71 0.96 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.824 0.345 . . . . 73.12 110.924 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -165.04 168.25 17.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 74.34 110.893 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -175.47 -36.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 73.4 110.868 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.0 -49.06 2.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 75.2 111.108 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.73 175.55 7.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 71.53 110.883 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.8 t -148.73 35.69 0.78 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 74.13 110.881 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -111.84 -75.96 0.6 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.182 -0.463 . . . . 73.43 110.909 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -77.82 60.41 2.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 65.02 110.827 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.5 p -84.34 156.97 21.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.453 . . . . 74.12 110.84 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 26.6 mm -142.96 141.07 27.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 74.12 111.15 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 12.7 mtt -144.63 142.68 30.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.206 -0.452 . . . . 73.43 110.876 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.6 m-20 -88.04 -174.85 4.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.429 . . . . 64.13 110.858 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -59.65 4.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 74.35 110.872 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.66 -58.64 5.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.317 -0.401 . . . . 75.02 110.889 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -49.62 -54.17 19.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.491 . . . . 73.14 110.89 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.1 p -55.71 -44.0 77.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.101 -0.499 . . . . 73.11 110.845 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.74 -43.45 80.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 72.14 110.839 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.1 -63.0 1.21 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.165 -0.47 . . . . 74.22 111.118 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -51.86 -46.1 64.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 75.51 110.895 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.69 -49.93 71.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.129 -0.487 . . . . 72.25 110.894 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.21 -42.38 60.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 64.21 111.059 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -69.87 -66.97 0.52 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.444 . . . . 74.14 110.889 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.9 m -47.31 -35.56 3.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 74.13 111.143 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -69.18 -54.34 15.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 73.22 110.973 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.67 -53.71 22.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 72.22 111.09 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.84 -48.14 80.35 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 75.13 110.881 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.65 -36.72 36.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 73.13 110.886 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.46 -53.62 10.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 75.13 111.07 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.23 -26.66 65.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 54.3 110.9 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 17.2 m -96.14 -16.27 7.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.487 . . . . 72.52 111.094 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 74.43 110.931 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 5.6 m . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.876 0.369 . . . . 73.32 111.103 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -101.21 154.88 36.92 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.575 0.702 . . . . 64.23 111.14 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -5.95 17.44 Favored 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.678 2.252 . . . . 72.52 112.332 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -93.67 -40.57 10.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.211 -0.45 . . . . 71.53 110.917 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -57.06 -62.04 2.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 71.33 110.902 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -39.8 -71.97 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 74.21 111.139 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.3 m -47.57 -38.73 6.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 75.25 111.142 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.82 -42.86 99.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 75.23 110.833 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.78 -40.01 87.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 74.5 111.144 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.445 HH11 ' HD2' ' A' ' 78' ' ' ARG . 1.3 mtp85 -65.71 -55.03 19.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.444 . . . . 72.44 110.881 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.8 mmtp -66.48 -22.61 66.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 74.11 110.895 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -69.99 -52.98 19.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.464 . . . . 71.23 110.912 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.0 mt -89.84 13.63 14.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 75.3 110.908 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 53.65 38.7 28.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 64.43 110.831 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -78.73 81.75 5.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 74.32 110.919 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -44.57 156.79 0.07 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.214 -0.448 . . . . 70.51 111.122 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -54.18 -24.71 19.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.16 -0.473 . . . . 75.24 110.849 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.4 mtmt -79.14 -47.54 15.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.218 -0.446 . . . . 75.15 110.926 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -65.28 -60.04 3.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.279 -0.419 . . . . 72.55 110.774 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.36 -34.92 17.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 73.15 111.085 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 84.9 p -77.78 -32.95 52.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 64.13 110.88 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -75.23 -29.98 60.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 73.53 110.882 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 17.8 mm -98.32 -63.08 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 75.43 111.1 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -73.11 -65.54 0.79 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.489 . . . . 75.43 110.896 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 125.21 32.6 0.78 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.719 -0.753 . . . . 63.14 112.459 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -51.92 -53.68 29.0 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.742 -0.742 . . . . 41.52 112.465 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 110.57 -136.23 13.44 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.687 -0.768 . . . . 74.32 112.506 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.24 -73.5 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.872 0.368 . . . . 63.43 111.127 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.64 42.66 0.98 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 71.14 110.889 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -59.7 -70.28 0.17 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.183 -0.462 . . . . 74.33 111.104 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -40.77 -48.78 3.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 75.24 110.88 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.7 m -55.13 -74.32 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 74.31 110.822 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -47.44 -55.17 9.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 75.44 110.865 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -48.56 -36.57 15.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.178 -0.465 . . . . 73.52 110.917 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -57.1 -41.98 79.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.099 -0.5 . . . . 74.53 110.863 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.39 -15.66 30.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 74.44 110.868 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.42 25.64 23.01 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.735 -0.745 . . . . 73.05 112.519 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -93.68 -22.72 18.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 71.42 110.871 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -107.03 19.45 20.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.155 -0.475 . . . . 43.5 111.046 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.53 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.0 OUTLIER -121.23 53.42 3.57 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.652 0.739 . . . . 71.15 110.905 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.0 Cg_endo -69.8 28.49 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.683 2.256 . . . . 75.43 112.286 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.711 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.8 m-70 70.38 36.98 0.12 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.566 0.698 . . . . 74.34 110.838 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.711 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.7 Cg_endo -69.68 -165.27 0.15 Allowed 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.727 2.285 . . . . 74.13 112.369 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.7 p -82.04 -33.13 30.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.039 0.447 . . . . 63.14 110.88 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 23.0 m -49.25 -43.02 42.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.028 -0.533 . . . . 73.42 111.179 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.402 HD13 ' CG ' ' A' ' 108' ' ' GLN . 27.2 mm -60.82 -47.08 94.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 75.11 111.144 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -27.7 68.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.145 -0.479 . . . . 73.22 110.942 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.4 mp -82.32 -45.64 14.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.203 -0.453 . . . . 74.04 110.848 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.406 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 14.5 mt -57.51 -46.89 83.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.44 . . . . 73.2 110.949 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 -55.62 -35.08 65.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.488 . . . . 72.2 110.849 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 33.3 m -95.54 -5.37 10.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 74.33 111.157 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.406 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.5 OUTLIER -88.84 -41.06 12.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.11 -0.496 . . . . 72.21 110.882 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -49.93 -31.82 13.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 72.41 110.876 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.11 -19.09 18.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 74.04 110.984 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 47.7 m-70 -128.61 88.24 52.73 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.539 0.685 . . . . 63.5 110.83 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 2.64 3.35 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.677 2.252 . . . . 63.34 112.357 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -115.73 -13.0 11.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.213 -0.448 . . . . 74.54 110.857 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.6 tp -54.49 -46.0 73.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.173 -0.467 . . . . 73.41 110.862 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.432 ' O ' ' HB3' ' A' ' 131' ' ' ARG . 0.8 OUTLIER -49.18 -30.12 6.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 64.0 110.931 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . 0.423 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.2 m-80 -85.52 -29.93 23.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 73.41 110.935 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.23 4.61 51.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 74.2 110.822 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 12.3 pt -124.06 -34.94 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.202 -0.453 . . . . 75.14 111.138 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.432 ' HB3' ' O ' ' A' ' 127' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 73.22 110.84 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mtt . . . . . 0 C--O 1.23 0.043 0 CA-C-O 120.837 0.351 . . . . 71.03 110.927 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.4 -169.33 0.44 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 75.44 110.941 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.445 ' O ' ' N ' ' A' ' 7' ' ' HIS . 0.1 OUTLIER 174.88 57.99 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.569 0.7 . . . . 74.45 110.938 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.75 -0.59 7.13 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.649 2.232 . . . . 74.04 112.353 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 29.5 m -90.01 -44.33 14.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.435 . . . . 73.21 111.119 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 14.2 p -119.51 -27.65 5.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 74.21 110.88 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.445 ' N ' ' O ' ' A' ' 3' ' ' CYS . 43.6 m-70 62.63 53.67 2.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 72.33 110.868 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -119.41 -75.16 0.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 75.22 110.956 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -98.87 -133.72 8.18 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.668 -0.777 . . . . 73.12 112.51 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -156.06 87.41 1.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.863 0.363 . . . . 72.33 110.926 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.524 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -48.69 105.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 75.52 110.826 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.2 p -141.85 126.48 16.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 74.24 111.163 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.3 p -49.27 131.71 19.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 73.31 110.908 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.411 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 177.98 80.66 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.805 -0.712 . . . . 74.04 112.481 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.411 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -37.08 146.9 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.882 0.372 . . . . 74.44 111.106 -179.985 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.24 -165.1 1.51 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 73.34 110.9 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -95.64 117.21 30.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.268 -0.424 . . . . 75.12 110.89 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.2 mm -107.79 91.23 7.22 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.62 0.724 . . . . 74.22 111.124 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 96.15 0.58 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.685 2.257 . . . . 72.51 112.364 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -60.96 -35.83 77.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 75.53 110.934 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.4 m -132.37 144.38 50.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 63.33 111.187 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -133.58 45.77 2.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 73.4 110.915 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.45 -68.46 0.61 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.085 -0.507 . . . . 75.55 110.832 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.52 -47.31 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.749 -0.739 . . . . 64.21 112.529 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.24 40.8 1.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.797 0.332 . . . . 74.34 110.856 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.2 tttm -53.92 117.64 3.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.189 -0.46 . . . . 73.32 110.92 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 t -130.07 92.85 3.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 73.42 111.134 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 40.7 t -77.31 125.88 37.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 73.31 111.115 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.84 51.55 2.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 73.25 110.889 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.9 mttm -37.94 108.06 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 75.42 110.923 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.66 47.08 0.42 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.738 -0.744 . . . . 73.35 112.527 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 14.8 mm -107.99 90.95 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.856 0.36 . . . . 74.32 111.113 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.89 154.14 39.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 61.35 110.839 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 168.25 -109.37 0.34 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.716 -0.754 . . . . 62.31 112.478 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.524 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 58.4 mt -156.89 86.86 0.98 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.815 0.34 . . . . 73.12 110.894 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -159.44 160.19 34.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 74.34 110.963 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 32.2 t -171.85 -39.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.162 -0.472 . . . . 73.4 110.918 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 p -123.26 -46.6 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.121 -0.49 . . . . 75.2 111.045 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -91.82 171.03 9.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.23 -0.441 . . . . 71.53 110.846 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.84 19.8 2.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 74.13 110.892 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -110.27 -63.13 1.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.255 -0.43 . . . . 73.43 110.876 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -76.87 61.94 2.0 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.124 -0.489 . . . . 65.02 110.914 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.7 p -95.42 154.81 17.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.078 -0.51 . . . . 74.12 110.846 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 18.2 mm -142.41 139.48 29.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 74.12 111.135 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.6 mtt -141.62 145.22 34.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 73.43 110.901 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.0 m-20 -90.55 -170.51 2.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 64.13 110.873 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.24 -61.08 2.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 74.35 110.853 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -51.49 -57.43 9.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 75.02 110.878 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.29 -58.67 5.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 73.14 110.875 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.7 t -52.18 -43.94 64.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 73.11 110.873 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.92 -44.02 81.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.119 -0.491 . . . . 72.14 110.895 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.46 -63.19 1.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 74.22 111.045 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -51.63 -47.42 63.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.288 -0.414 . . . . 75.51 110.927 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -49.37 75.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 72.25 110.844 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.52 -43.11 62.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.258 -0.428 . . . . 64.21 111.153 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -69.28 -66.73 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 74.14 110.875 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 11.4 m -47.27 -37.02 4.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.277 -0.42 . . . . 74.13 111.058 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -67.17 -54.79 17.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 73.22 110.829 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.32 -52.32 28.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.441 . . . . 72.22 111.084 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.83 -50.08 68.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.281 -0.418 . . . . 75.13 110.818 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.404 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -50.41 -34.99 26.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 73.13 110.881 -179.878 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.26 -56.19 5.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 75.13 111.066 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.89 -32.21 52.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 54.3 110.81 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 61' ' ' ARG . 34.3 m -89.03 -24.79 5.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.165 -0.47 . . . . 72.52 111.131 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.169 -0.469 . . . . 74.43 110.877 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 16.0 m . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.88 0.371 . . . . 73.32 111.159 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -106.2 160.15 27.21 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.535 0.683 . . . . 64.23 111.079 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 -8.2 22.99 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.634 2.222 . . . . 72.52 112.324 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.41 -37.46 10.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 71.53 110.924 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -55.94 -59.42 4.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 71.33 110.835 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -46.27 -69.32 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.18 -0.464 . . . . 74.21 111.139 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.3 m -47.54 -38.02 5.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 75.25 111.145 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -61.59 -45.2 95.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.485 . . . . 75.23 110.916 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.6 t -63.03 -38.92 83.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.444 . . . . 74.5 111.134 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.1 OUTLIER -64.23 -54.79 27.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 72.44 110.892 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.99 -21.61 64.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 74.11 110.909 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -70.11 -53.69 16.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 71.23 110.896 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.6 mt -90.89 13.88 15.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 75.3 110.896 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 52.64 38.64 26.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 64.43 110.819 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -79.01 86.48 4.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.137 -0.483 . . . . 74.32 110.909 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.82 156.74 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 70.51 111.175 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -56.88 -22.07 34.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 75.24 110.937 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.63 -52.42 7.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 75.15 110.903 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -58.93 -55.38 35.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 72.55 110.919 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -50.85 -31.64 17.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.49 . . . . 73.15 111.067 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 7.5 p -80.97 -32.13 34.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.435 . . . . 64.13 110.899 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.77 -21.82 54.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.075 -0.511 . . . . 73.53 110.887 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 22.4 mm -107.37 -61.71 2.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.47 . . . . 75.43 111.082 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -75.91 -64.04 1.17 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 75.43 110.852 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 116.49 49.21 0.44 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.763 -0.732 . . . . 63.14 112.443 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -72.03 -36.72 60.58 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.743 -0.741 . . . . 41.52 112.516 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.03 -123.52 7.15 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.727 -0.749 . . . . 74.32 112.474 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.401 HG12 ' H ' ' A' ' 97' ' ' ASN . 0.1 OUTLIER -120.46 -62.03 2.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 63.43 111.1 -179.986 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.401 ' H ' HG12 ' A' ' 96' ' ' VAL . 12.8 p30 -85.61 39.94 0.82 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 71.14 110.914 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.425 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -60.74 -77.54 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 74.33 111.068 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.425 ' C ' ' O ' ' A' ' 98' ' ' ALA . 54.7 m-85 -35.91 -46.74 0.48 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 75.24 110.884 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -57.35 -76.4 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 74.31 110.865 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 8.9 mtt180 -47.92 -52.73 18.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 75.44 110.865 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -49.04 -38.62 24.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 73.52 110.949 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -52.79 -41.33 64.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.087 -0.506 . . . . 74.53 110.854 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.79 -17.24 24.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 74.44 110.977 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 94.08 25.51 16.78 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.757 -0.735 . . . . 73.05 112.505 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -92.89 -23.37 18.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.882 0.373 . . . . 71.42 110.938 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -103.86 17.22 24.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 43.5 111.079 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.53 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.9 OUTLIER -120.3 55.02 3.72 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.605 0.717 . . . . 71.15 110.98 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 54.1 Cg_endo -69.66 27.6 0.17 Allowed 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.633 2.222 . . . . 75.43 112.396 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.718 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.8 m-70 70.34 37.17 0.13 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.595 0.712 . . . . 74.34 110.869 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.718 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.5 Cg_endo -69.75 -165.25 0.15 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.67 2.247 . . . . 74.13 112.306 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 31.8 m -83.27 -33.44 26.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 63.14 110.818 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 23.9 m -49.09 -41.66 36.35 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.116 -0.493 . . . . 73.42 111.141 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 25.1 mm -60.6 -44.16 96.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.266 -0.425 . . . . 75.11 111.1 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.28 -29.18 70.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 73.22 110.927 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.4 mp -81.23 -43.24 19.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 74.04 110.937 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.424 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 18.5 mt -60.5 -49.06 79.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.228 -0.442 . . . . 73.2 110.939 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -52.86 -38.52 61.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 72.2 110.843 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 33.4 m -89.86 -11.08 10.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 74.33 111.094 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.5 OUTLIER -81.6 -39.87 23.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.206 -0.452 . . . . 72.21 110.925 179.927 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.85 -30.38 14.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 72.41 110.832 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -98.3 -18.3 18.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 74.04 110.956 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 -130.56 88.69 46.15 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.615 0.721 . . . . 63.5 110.879 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.77 2.61 3.38 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.707 2.272 . . . . 63.34 112.367 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -116.44 -12.22 11.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 74.54 110.859 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.5 tp -54.22 -46.64 72.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 73.41 110.862 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -49.36 -29.59 6.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 64.0 110.901 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . 0.453 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.0 m-80 -86.16 -29.29 23.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.224 -0.444 . . . . 73.41 110.864 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -92.29 4.68 52.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 74.2 110.946 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 12.1 pt -124.04 -34.95 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.099 -0.501 . . . . 75.14 111.143 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.453 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 73.22 110.899 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mmt . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.818 0.342 . . . . 71.03 110.822 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.78 -170.73 0.5 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 75.44 110.859 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 1.7 p 178.05 56.22 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.53 0.681 . . . . 74.45 110.794 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.405 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 55.2 Cg_endo -69.72 -8.83 24.6 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.699 2.266 . . . . 74.04 112.37 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.0 m -67.21 -49.98 67.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 73.21 111.115 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.2 m -133.2 -21.1 2.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.093 -0.503 . . . . 74.21 110.845 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 66.91 88.96 0.1 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.253 -0.431 . . . . 72.33 110.87 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.61 HE21 ' N ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -132.34 -66.57 0.69 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.249 -0.432 . . . . 75.22 110.933 -179.895 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -127.37 -92.9 0.8 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.814 -0.707 . . . . 73.12 112.529 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 178.34 91.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.838 0.351 . . . . 72.33 110.845 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.542 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.0 OUTLIER -57.23 99.65 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 75.52 110.865 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -139.7 128.95 28.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 74.24 111.152 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 42.3 m -48.87 130.44 18.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.182 -0.463 . . . . 73.31 110.852 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.404 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 177.49 82.13 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.658 -0.782 . . . . 74.04 112.471 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.404 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.7 OUTLIER -37.59 147.17 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.881 0.372 . . . . 74.44 111.118 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.56 -168.61 2.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.454 . . . . 73.34 110.886 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -95.02 113.6 25.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 75.12 110.868 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.7 mm -106.67 88.5 3.5 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.609 0.719 . . . . 74.22 111.125 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.486 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 54.1 Cg_endo -69.75 99.52 0.75 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.699 2.266 . . . . 72.51 112.374 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -65.07 -32.47 74.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.279 -0.419 . . . . 75.53 110.917 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.406 ' HB ' ' HA ' ' A' ' 26' ' ' LYS . 23.5 m -130.68 147.83 52.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.129 -0.487 . . . . 63.33 111.098 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -147.7 35.14 0.85 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 73.4 110.864 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.48 -43.0 2.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 75.55 110.926 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -154.56 -52.96 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.741 -0.742 . . . . 64.21 112.504 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.51 44.77 1.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.856 0.36 . . . . 74.34 110.886 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.406 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 9.9 tttm -50.11 118.39 2.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 73.32 110.903 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.0 t -136.46 82.88 1.97 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 73.42 111.157 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.486 ' HA ' ' HA ' ' A' ' 19' ' ' PRO . 1.7 p -73.96 133.82 30.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.201 -0.454 . . . . 73.31 111.186 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' A' ' 30' ' ' LYS . 0.2 OUTLIER -84.41 53.73 2.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 73.25 110.894 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.403 ' C ' ' O ' ' A' ' 29' ' ' LEU . 13.8 mttm -37.07 105.88 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 75.42 110.895 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.47 50.8 0.36 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.736 -0.745 . . . . 73.35 112.527 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 22.9 mm -107.36 96.53 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.817 0.341 . . . . 74.32 111.115 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -77.57 153.26 33.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 61.35 110.825 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.19 -108.43 0.31 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.745 -0.74 . . . . 62.31 112.545 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.542 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 48.4 mt -156.88 85.8 0.97 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.858 0.361 . . . . 73.12 110.892 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -162.3 164.54 27.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 74.34 110.95 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 43.0 t -168.31 -38.76 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.145 -0.48 . . . . 73.4 110.9 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.1 m -128.44 -45.63 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 75.2 111.18 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.02 169.28 11.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 71.53 110.889 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 10.6 p -134.93 7.38 3.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.223 -0.444 . . . . 74.13 110.849 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -94.55 -65.02 1.01 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 73.43 110.921 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -76.49 61.56 1.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.101 -0.5 . . . . 65.02 110.885 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.3 p -99.92 158.31 15.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.091 -0.504 . . . . 74.12 110.887 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 23.9 mm -142.37 140.18 29.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.491 . . . . 74.12 111.139 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.3 mtm -145.14 132.04 20.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 73.43 110.837 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 -84.91 -170.42 3.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.443 . . . . 64.13 110.845 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -55.22 32.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 74.35 110.985 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.38 -55.57 33.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.181 -0.463 . . . . 75.02 110.836 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -52.29 -60.83 2.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 73.14 110.892 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.7 t -54.71 -38.03 66.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 73.11 110.876 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -59.15 -45.7 90.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.126 -0.488 . . . . 72.14 110.869 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.48 -57.94 7.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 74.22 111.057 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -54.16 -46.99 72.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 75.51 110.92 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.57 -50.27 67.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.14 -0.482 . . . . 72.25 110.879 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.22 -40.64 59.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 64.21 111.066 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -71.02 -67.51 0.5 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.452 . . . . 74.14 110.921 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.4 m -47.24 -35.19 3.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.179 -0.464 . . . . 74.13 111.15 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -70.97 -51.26 26.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 73.22 110.897 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.77 -49.43 62.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.263 -0.426 . . . . 72.22 111.124 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -67.0 -48.09 69.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 75.13 110.808 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.12 -50.12 49.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 73.13 110.899 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.62 -54.37 32.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 75.13 111.066 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.87 -38.81 37.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 54.3 110.881 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 37.2 t -81.86 -25.47 9.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 72.52 111.104 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 74.43 110.852 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 11.5 m . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 120.824 0.345 . . . . 73.32 111.135 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -105.41 159.86 28.02 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.624 0.726 . . . . 64.23 111.101 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 -7.14 20.31 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.678 2.252 . . . . 72.52 112.379 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.98 -37.98 11.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.219 -0.446 . . . . 71.53 110.892 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -57.51 -61.61 2.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 71.33 110.879 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -44.87 -67.32 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 74.21 111.099 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.0 m -49.3 -39.12 12.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 75.25 111.099 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -60.88 -45.72 93.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 75.23 110.898 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 76.7 t -61.33 -39.12 81.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 74.5 111.167 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.08 -59.34 4.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 72.44 110.915 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -22.72 67.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.926 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -69.21 -53.13 21.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 71.23 110.905 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.6 mt -90.69 12.95 17.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 75.3 110.931 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 54.54 37.51 28.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.429 . . . . 64.43 110.871 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -80.02 87.11 5.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.109 -0.496 . . . . 74.32 110.899 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.77 157.17 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 70.51 111.142 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -57.6 -21.33 38.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 75.24 110.948 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.0 mmtp -81.3 -49.89 10.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.442 . . . . 75.15 110.914 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -62.31 -52.36 63.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.436 . . . . 72.55 110.913 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.76 -36.49 67.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 73.15 111.084 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 30.6 t -79.18 -26.34 42.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 64.13 110.856 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -81.15 -27.69 35.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 73.53 110.883 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 26.5 mm -101.11 -59.09 3.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.116 -0.493 . . . . 75.43 111.172 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -75.7 -61.29 1.97 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 75.43 110.878 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.32 48.98 0.78 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.754 -0.736 . . . . 63.14 112.471 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.61 -38.91 31.12 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.737 -0.744 . . . . 41.52 112.499 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 106.98 165.56 22.28 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.749 -0.738 . . . . 74.32 112.52 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.8 p -51.4 -51.39 24.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.896 0.379 . . . . 63.43 111.135 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -87.24 39.17 0.85 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 71.14 110.866 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.7 -76.28 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 74.33 111.108 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -43.41 -39.72 3.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.439 . . . . 75.24 110.91 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 38.9 t -59.95 -75.57 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 74.31 110.818 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 36.2 mtt180 -50.61 -45.21 57.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 75.44 110.829 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -56.25 -36.67 68.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.268 -0.423 . . . . 73.52 110.932 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -52.13 -28.99 19.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.122 -0.49 . . . . 74.53 110.854 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.77 -22.63 12.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.203 -0.453 . . . . 74.44 110.862 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.92 27.19 9.07 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.772 -0.727 . . . . 73.05 112.498 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -98.13 -6.62 31.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.791 0.329 . . . . 71.42 110.879 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -110.33 10.15 23.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 43.5 111.126 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.49 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -125.14 57.27 15.79 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.598 0.714 . . . . 71.15 110.947 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.509 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.2 Cg_endo -69.82 36.68 0.24 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.671 2.247 . . . . 75.43 112.341 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.775 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.7 OUTLIER 73.9 32.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.554 0.693 . . . . 74.34 110.835 179.918 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.775 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.6 Cg_endo -69.74 -163.99 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.764 2.31 . . . . 74.13 112.322 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.4 p -86.65 -29.4 22.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.435 . . . . 63.14 110.84 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 34.5 m -53.41 -50.76 64.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.089 -0.505 . . . . 73.42 111.112 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 43.3 mm -51.34 -42.5 27.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.264 -0.425 . . . . 75.11 111.136 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -29.86 69.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.225 -0.443 . . . . 73.22 110.868 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.7 mp -79.11 -41.64 28.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.277 -0.42 . . . . 74.04 110.886 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 14.8 mt -64.32 -49.27 72.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.149 -0.478 . . . . 73.2 110.962 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 15.3 ptp180 -51.92 -34.94 43.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 72.2 110.886 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 29.5 m -93.57 -14.74 8.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 74.33 111.194 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.477 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.5 OUTLIER -76.05 -39.33 55.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 72.21 110.966 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.67 -30.52 13.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.227 -0.442 . . . . 72.41 110.859 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -96.72 -20.01 18.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 74.04 110.886 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 65.6 m-70 -131.21 90.05 39.76 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 121.619 0.723 . . . . 63.5 110.881 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 -0.07 6.32 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.758 2.305 . . . . 63.34 112.345 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -113.48 -11.92 13.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.216 -0.447 . . . . 74.54 110.902 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 6.3 tp -53.81 -47.78 70.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.149 -0.478 . . . . 73.41 110.845 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.428 ' HA ' HG12 ' A' ' 130' ' ' ILE . 2.1 pt? -51.1 -28.95 11.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 64.0 110.934 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . 0.47 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.73 -26.05 24.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 73.41 110.869 179.929 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -96.02 3.52 53.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 74.2 110.86 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . 0.428 HG12 ' HA ' ' A' ' 127' ' ' LEU . 12.7 pt -122.41 -34.49 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 75.14 111.207 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.47 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 73.22 110.875 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mmt . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.843 0.354 . . . . 71.03 110.919 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.7 -169.61 0.43 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.429 . . . . 75.44 110.903 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 p 176.92 57.84 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.677 0.751 . . . . 74.45 110.872 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 3.71 2.62 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.679 2.253 . . . . 74.04 112.332 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.2 m -95.66 -42.46 12.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 73.21 111.143 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.38 -32.69 3.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.15 -0.477 . . . . 74.21 110.831 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 65.35 51.02 1.64 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 72.33 110.851 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 94.8 mm-40 -114.59 -75.42 0.59 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 75.22 110.9 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -99.18 -112.43 3.3 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.79 -0.719 . . . . 73.12 112.526 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -175.81 97.12 0.07 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.81 0.338 . . . . 72.33 110.92 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.536 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.4 ptp -55.64 106.14 0.23 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 75.52 110.895 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.3 p -148.63 129.61 5.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.218 -0.446 . . . . 74.24 111.16 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -45.3 125.21 5.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 73.31 110.844 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.9 82.17 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.759 -0.734 . . . . 74.04 112.488 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -38.34 148.87 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.864 0.364 . . . . 74.44 111.133 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.47 -164.74 1.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 73.34 110.9 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.4 116.66 30.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.211 -0.449 . . . . 75.12 110.871 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.4 mm -107.56 91.78 7.65 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.607 0.718 . . . . 74.22 111.158 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 95.81 0.56 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.751 2.301 . . . . 72.51 112.379 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -60.18 -40.39 89.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.0 0.428 . . . . 75.53 110.875 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.6 m -127.83 145.23 51.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 63.33 111.159 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -134.25 45.09 2.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 73.4 110.872 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.99 -68.44 0.63 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 75.55 110.865 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.35 -47.0 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.798 -0.715 . . . . 64.21 112.541 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.15 39.83 1.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.813 0.34 . . . . 74.34 110.852 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.8 tttm -52.96 117.92 3.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 73.32 110.904 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.8 t -131.41 93.98 3.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 73.42 111.139 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 42.0 t -77.78 126.05 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.441 . . . . 73.31 111.147 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.28 52.42 2.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.153 -0.476 . . . . 73.25 110.966 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -39.19 106.92 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 75.42 110.901 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.88 45.6 0.37 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.698 -0.763 . . . . 73.35 112.437 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 14.3 mm -106.66 90.35 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.829 0.347 . . . . 74.32 111.118 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.54 158.57 34.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 61.35 110.888 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 164.42 -106.58 0.28 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.782 -0.723 . . . . 62.31 112.513 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.536 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 47.7 mt -156.63 82.65 0.96 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.839 0.352 . . . . 73.12 110.926 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.425 ' CD1' ' N ' ' A' ' 36' ' ' TYR . 0.1 OUTLIER -165.66 169.03 15.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.454 . . . . 74.34 110.932 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -176.6 -35.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 73.4 110.927 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -123.52 -45.94 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 75.2 111.071 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -95.33 176.44 6.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.128 -0.487 . . . . 71.53 110.844 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.4 p -148.54 30.71 0.82 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.19 -0.459 . . . . 74.13 110.885 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -105.14 -76.32 0.61 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 73.43 110.9 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -78.28 60.27 2.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 65.02 110.869 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.2 p -84.23 157.82 21.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 74.12 110.879 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 24.8 mm -143.81 140.91 25.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 74.12 111.139 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.7 mtt -143.8 145.43 32.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.066 -0.516 . . . . 73.43 110.857 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 41.7 m-20 -91.52 -169.97 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 64.13 110.83 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.69 -60.73 3.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 74.35 110.892 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -51.19 -57.41 8.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 75.02 110.908 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.02 -57.92 7.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.11 -0.496 . . . . 73.14 110.915 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.0 t -53.46 -42.17 66.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.124 -0.489 . . . . 73.11 110.853 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -57.6 -44.67 85.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 72.14 110.878 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.76 -61.51 2.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 74.22 111.155 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -52.32 -47.29 66.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 75.51 110.848 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -49.6 73.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 72.25 110.835 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.44 -42.27 61.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.256 -0.429 . . . . 64.21 111.127 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -69.96 -66.67 0.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 74.14 110.886 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.0 m -47.45 -35.63 4.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.434 . . . . 74.13 111.167 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -69.04 -54.58 14.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 73.22 110.857 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.7 -54.35 19.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 72.22 111.105 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.79 -48.91 78.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 75.13 110.928 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.47 -39.44 33.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 73.13 110.839 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.52 -54.33 12.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 75.13 111.096 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.24 -31.39 63.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 54.3 110.826 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 11.2 m -88.18 -22.51 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 72.52 111.175 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 74.43 110.859 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.848 0.356 . . . . 73.32 111.091 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.99 155.63 77.43 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.621 0.724 . . . . 64.23 111.107 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.62 -6.93 19.72 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.736 2.29 . . . . 72.52 112.347 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.17 -36.69 9.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 71.53 110.917 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -59.06 -61.72 2.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.495 . . . . 71.33 110.856 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -39.43 -69.62 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 74.21 111.134 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.7 m -49.54 -40.01 14.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.093 -0.503 . . . . 75.25 111.168 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.2 mtmt -60.92 -45.12 95.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 75.23 110.933 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 21.9 t -60.83 -39.79 83.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.146 -0.479 . . . . 74.5 111.086 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.98 -59.55 4.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 72.44 110.909 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt -63.05 -22.85 67.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 74.11 110.895 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -68.92 -52.95 24.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 71.23 110.84 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.7 mt -91.12 13.1 17.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.245 -0.434 . . . . 75.3 110.906 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.2 m 55.35 38.34 30.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.447 . . . . 64.43 110.837 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.54 86.67 5.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 74.32 110.92 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.53 157.23 0.15 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.482 . . . . 70.51 111.124 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -56.26 -21.74 25.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 75.24 110.911 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -81.97 -48.85 10.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.206 -0.452 . . . . 75.15 110.959 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -61.89 -56.88 14.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 72.55 110.886 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.78 -38.04 53.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.169 -0.469 . . . . 73.15 111.099 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 27.0 t -77.69 -26.75 50.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 64.13 110.797 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -80.85 -29.21 35.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 73.53 110.868 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 18.2 mm -99.8 -60.95 2.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 75.43 111.106 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -72.69 -60.74 2.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 75.43 110.851 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 108.72 46.36 0.97 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.734 -0.746 . . . . 63.14 112.487 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -75.55 -43.78 23.15 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.722 -0.751 . . . . 41.52 112.562 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.34 167.9 21.19 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.77 -0.729 . . . . 74.32 112.502 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.1 p -52.33 -50.02 39.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.794 0.33 . . . . 63.43 111.172 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -86.66 37.61 0.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.115 -0.493 . . . . 71.14 110.862 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.6 -75.82 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.449 . . . . 74.33 111.044 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -44.42 -40.46 5.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.259 -0.428 . . . . 75.24 110.857 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.2 m -59.68 -74.76 0.07 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 74.31 110.838 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 16.3 mtt85 -50.19 -45.77 53.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.075 -0.511 . . . . 75.44 110.85 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -56.09 -36.36 68.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.221 -0.445 . . . . 73.52 110.89 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -51.45 -29.23 15.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.473 . . . . 74.53 110.92 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -108.55 -23.02 12.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 74.44 110.921 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.09 26.54 8.8 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.723 -0.751 . . . . 73.05 112.438 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -96.99 -4.85 39.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.805 0.336 . . . . 71.42 110.888 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -112.58 8.4 19.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.216 -0.447 . . . . 43.5 111.144 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.494 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -125.2 57.1 15.42 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.577 0.703 . . . . 71.15 110.87 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.515 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.2 Cg_endo -69.82 35.88 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.679 2.253 . . . . 75.43 112.279 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.786 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 1.1 t-80 74.79 31.28 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.644 0.735 . . . . 74.34 110.887 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.786 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.9 Cg_endo -69.78 -163.78 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.707 2.272 . . . . 74.13 112.306 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.14 -29.78 24.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.17 -0.468 . . . . 63.14 110.84 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 21.9 m -53.06 -52.18 59.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 73.42 111.134 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 38.8 mm -51.11 -45.14 30.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 75.11 111.183 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -28.46 69.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 73.22 110.917 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 5.9 mp -79.53 -42.92 24.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 74.04 110.905 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.443 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 7.3 mt -62.03 -47.64 83.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 73.2 110.898 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -54.74 -34.29 62.29 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.192 -0.458 . . . . 72.2 110.903 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 32.1 m -94.59 -10.13 9.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.164 -0.471 . . . . 74.33 111.083 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.6 OUTLIER -82.57 -40.19 21.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.197 -0.456 . . . . 72.21 110.924 179.907 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -49.54 -32.79 13.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.452 . . . . 72.41 110.882 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.52 -21.13 19.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 74.04 110.905 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 -129.83 90.26 43.61 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.58 0.705 . . . . 63.5 110.911 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.71 -0.72 7.28 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.674 2.25 . . . . 63.34 112.358 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -112.2 -12.39 13.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 74.54 110.792 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 6.5 tp -53.79 -47.84 70.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.259 -0.428 . . . . 73.41 110.908 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.43 ' HA ' HG12 ' A' ' 130' ' ' ILE . 2.2 pt? -51.27 -28.67 12.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.212 -0.449 . . . . 64.0 110.905 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . 0.469 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.87 -26.13 24.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 73.41 110.861 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -95.78 2.99 54.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 74.2 110.912 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . 0.43 HG12 ' HA ' ' A' ' 127' ' ' LEU . 13.1 pt -121.79 -34.55 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.138 -0.483 . . . . 75.14 111.117 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.469 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.7 ptt-85 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.14 -0.482 . . . . 73.22 110.851 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.2 mmt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.827 0.346 . . . . 71.03 110.818 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.65 -170.36 0.48 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 75.44 110.898 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.7 p 177.67 57.54 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.551 0.691 . . . . 74.45 110.92 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 3.58 2.66 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.672 2.248 . . . . 74.04 112.302 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 4.9 m -96.38 -42.69 12.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.289 -0.414 . . . . 73.21 111.172 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -120.54 -33.03 3.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.475 . . . . 74.21 110.922 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 65.29 51.46 1.59 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 72.33 110.906 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 95.5 mm-40 -118.2 -75.42 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 75.22 110.949 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.51 -115.63 2.96 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.688 -0.768 . . . . 73.12 112.475 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -174.88 95.38 0.08 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.837 0.351 . . . . 72.33 110.843 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.509 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.2 ptp -54.71 105.99 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.492 . . . . 75.52 110.847 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.1 p -148.57 129.12 4.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 74.24 111.106 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -45.22 128.55 7.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.123 -0.49 . . . . 73.31 110.892 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.401 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 179.88 80.0 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.791 -0.718 . . . . 74.04 112.509 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.401 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.8 145.9 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.876 0.369 . . . . 74.44 111.126 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.23 -167.9 2.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.183 -0.462 . . . . 73.34 110.933 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -94.39 116.18 28.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 75.12 110.861 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.449 ' O ' ' HA ' ' A' ' 28' ' ' VAL . 9.3 mm -108.03 90.87 7.07 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.594 0.711 . . . . 74.22 111.128 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.441 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 53.0 Cg_endo -69.83 104.07 1.27 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.706 2.27 . . . . 72.51 112.286 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -71.49 -28.47 63.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.16 -0.473 . . . . 75.53 110.889 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.414 ' HB ' ' HA ' ' A' ' 26' ' ' LYS . 27.4 m -131.31 149.42 52.57 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.059 -0.519 . . . . 63.33 111.14 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.83 41.18 0.76 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.232 -0.44 . . . . 73.4 110.907 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -129.83 -48.45 1.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 75.55 110.927 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -146.34 -49.43 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.743 -0.741 . . . . 64.21 112.533 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.22 46.34 0.92 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.834 0.35 . . . . 74.34 110.797 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.414 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 11.3 tttt -49.52 112.14 0.6 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.263 -0.426 . . . . 73.32 110.884 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.3 t -132.81 96.11 3.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.242 -0.436 . . . . 73.42 111.182 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.449 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 0.7 OUTLIER -84.65 140.34 16.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 73.31 111.164 179.928 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.418 ' O ' HG12 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -86.58 63.7 8.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 73.25 110.929 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -42.36 104.39 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 75.42 110.913 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.53 60.47 0.3 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.706 -0.759 . . . . 73.35 112.554 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.418 HG12 ' O ' ' A' ' 29' ' ' LEU . 18.2 mm -116.63 93.05 2.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.856 0.36 . . . . 74.32 111.117 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.43 157.38 34.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 61.35 110.932 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 163.48 -106.77 0.28 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.769 -0.729 . . . . 62.31 112.533 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.509 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 49.6 mt -156.53 83.44 0.97 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.886 0.374 . . . . 73.12 110.966 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.446 ' CD1' ' N ' ' A' ' 36' ' ' TYR . 0.1 OUTLIER -167.64 169.5 11.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 74.34 110.994 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -178.88 -34.77 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.199 -0.455 . . . . 73.4 110.927 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.5 m -122.28 -44.99 2.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 75.2 111.138 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -98.53 177.45 5.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 71.53 110.862 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 29.0 p -148.47 26.51 0.94 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.209 -0.45 . . . . 74.13 110.911 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.8 mp0 -100.66 -76.75 0.55 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.138 -0.483 . . . . 73.43 110.859 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -78.38 59.54 2.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.076 -0.511 . . . . 65.02 110.923 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.2 p -84.39 159.25 20.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.072 -0.513 . . . . 74.12 110.82 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 28.2 mm -142.81 140.61 27.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.082 -0.508 . . . . 74.12 111.103 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.0 mtm -145.4 135.11 23.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 73.43 110.928 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -81.53 -170.08 2.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.294 -0.412 . . . . 64.13 110.879 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.34 -58.96 5.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 74.35 110.922 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -52.73 -56.99 11.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 75.02 110.843 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.75 -59.28 4.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 73.14 110.912 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.8 t -53.31 -38.27 63.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 73.11 110.864 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.69 -43.71 98.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 72.14 110.838 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.08 -57.5 8.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 74.22 111.008 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -55.01 -47.3 74.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.256 -0.429 . . . . 75.51 110.84 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.95 -48.87 74.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.213 -0.449 . . . . 72.25 110.916 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.97 -41.75 64.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 64.21 111.084 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.414 ' HB2' ' HG ' ' A' ' 29' ' ' LEU . 3.4 mt-30 -69.52 -66.35 0.6 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 74.14 110.904 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 27.2 m -47.4 -42.52 7.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 74.13 111.074 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.7 mmtp -64.03 -50.76 67.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 73.22 110.836 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.53 -50.71 52.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 72.22 111.099 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -67.82 -43.95 78.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.233 -0.439 . . . . 75.13 110.924 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 36.5 mtp85 -51.04 -43.95 61.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 73.13 110.895 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.33 -55.42 8.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 75.13 111.097 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.83 -37.93 53.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 54.3 110.839 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 5.2 p -84.86 -22.82 7.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 72.52 111.093 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 74.43 110.9 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.858 0.361 . . . . 73.32 111.123 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.27 160.81 61.71 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.55 0.691 . . . . 64.23 111.071 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 -7.63 21.55 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.632 2.222 . . . . 72.52 112.413 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -101.16 -36.28 9.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 71.53 110.919 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -56.6 -61.4 2.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 71.33 110.922 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -44.33 -68.7 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 74.21 111.089 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 28.1 m -48.53 -39.23 10.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 75.25 111.143 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.1 mtmt -60.68 -39.59 88.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 75.23 110.872 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 90.2 t -70.14 -36.91 70.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.189 -0.459 . . . . 74.5 111.126 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.3 OUTLIER -69.96 -34.27 73.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.192 -0.458 . . . . 72.44 110.917 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.7 ptpt -88.73 -19.78 25.65 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.181 -0.463 . . . . 74.11 110.861 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -75.85 -50.63 14.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.258 -0.428 . . . . 71.23 110.87 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.1 mt -91.27 13.14 18.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.274 -0.421 . . . . 75.3 110.932 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 7.5 t 52.22 41.18 30.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 64.43 110.857 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -79.48 85.0 5.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 74.32 110.913 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -46.84 155.99 0.23 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 70.51 111.143 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -59.1 -20.62 55.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 75.24 110.902 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.01 -53.57 6.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 75.15 110.922 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.9 -53.79 34.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 72.55 110.885 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.49 -31.87 25.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 73.15 111.046 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 44.4 t -80.24 -39.95 28.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.266 -0.425 . . . . 64.13 110.795 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -71.69 -20.89 61.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.473 . . . . 73.53 110.861 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 53.3 mt -104.31 -64.05 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 75.43 111.098 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -74.58 -61.15 1.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 75.43 110.834 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 113.09 47.96 0.63 Allowed Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.7 -0.762 . . . . 63.14 112.494 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -68.04 -38.46 88.48 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.753 -0.737 . . . . 41.52 112.472 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 98.72 -164.94 20.98 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.768 -0.73 . . . . 74.32 112.489 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 5.2 t -71.41 -70.71 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.805 0.336 . . . . 63.43 111.107 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 26.1 t30 -84.87 39.41 0.75 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 71.14 110.847 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.54 -71.69 0.14 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 74.33 111.016 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -41.15 -42.74 2.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 75.24 110.872 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.44 -74.72 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.162 -0.472 . . . . 74.31 110.86 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 10.0 mtt180 -48.27 -49.45 33.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.095 -0.502 . . . . 75.44 110.924 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -53.8 -37.23 63.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 73.52 110.901 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -53.36 -34.65 58.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.135 -0.484 . . . . 74.53 110.88 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.61 -19.83 16.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 74.44 110.9 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.08 26.74 11.9 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.775 -0.726 . . . . 73.05 112.444 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -98.82 -6.16 29.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.882 0.372 . . . . 71.42 110.898 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -117.44 17.58 14.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.479 . . . . 43.5 111.099 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.466 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -126.48 55.31 13.54 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.552 0.692 . . . . 71.15 110.944 -179.929 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.473 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.0 Cg_endo -69.8 38.5 0.26 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.667 2.245 . . . . 75.43 112.37 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.732 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.7 t60 71.63 34.9 0.08 OUTLIER Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 121.604 0.716 . . . . 74.34 110.88 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.732 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.1 Cg_endo -69.82 -163.88 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.184 0 C-N-CA 122.714 2.276 . . . . 74.13 112.319 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 83.9 p -86.82 -29.56 22.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 63.14 110.889 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 18.8 m -56.25 -47.19 79.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.09 -0.505 . . . . 73.42 111.114 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 47.5 mm -56.29 -44.83 80.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 75.11 111.182 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -28.97 68.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.108 -0.496 . . . . 73.22 110.892 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 5.6 mp -79.36 -42.12 26.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.259 -0.428 . . . . 74.04 110.945 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.45 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 19.3 mt -63.57 -48.84 75.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.241 -0.436 . . . . 73.2 110.917 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 15.3 ptp180 -52.61 -35.4 54.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 72.2 110.889 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 28.8 m -93.09 -13.36 8.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 74.33 111.11 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.45 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.4 OUTLIER -78.05 -40.23 39.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 72.21 110.899 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -49.95 -30.91 11.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.124 -0.489 . . . . 72.41 110.88 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.7 -20.3 17.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 74.04 110.895 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -127.98 87.73 54.89 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.557 0.694 . . . . 63.5 110.826 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 3.42 2.79 Favored 'Trans proline' 0 N--CA 1.465 -0.174 0 C-N-CA 122.686 2.258 . . . . 63.34 112.384 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -117.19 -12.75 10.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 74.54 110.859 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.3 tp -53.95 -46.91 71.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 73.41 110.919 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.402 ' HA ' HG12 ' A' ' 130' ' ' ILE . 1.7 pt? -49.48 -29.64 6.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.476 . . . . 64.0 110.872 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . 0.481 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.42 -28.37 23.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 73.41 110.891 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.29 4.36 54.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.185 -0.461 . . . . 74.2 110.855 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . 0.402 HG12 ' HA ' ' A' ' 127' ' ' LEU . 13.0 pt -123.24 -35.03 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 75.14 111.163 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.481 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.8 ptt-85 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.481 . . . . 73.22 110.89 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 mmt . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.882 0.373 . . . . 71.03 110.874 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.35 -169.64 0.46 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.446 . . . . 75.44 110.92 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 1.7 p 178.78 55.74 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.592 0.71 . . . . 74.45 110.891 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 53.5 Cg_endo -69.77 -8.64 24.12 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.674 2.249 . . . . 74.04 112.346 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.8 m -67.49 -49.48 70.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.198 -0.455 . . . . 73.21 111.082 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.2 m -133.3 -20.98 2.08 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.187 -0.461 . . . . 74.21 110.933 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 66.58 89.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 72.33 110.874 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.618 HE21 ' N ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -132.14 -65.89 0.72 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 75.22 110.94 -179.903 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.401 ' HA3' ' HB3' ' A' ' 39' ' ' HIS . . . -129.54 -95.4 0.77 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.739 -0.744 . . . . 73.12 112.464 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -177.67 95.3 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.805 0.336 . . . . 72.33 110.866 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.539 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -62.27 102.65 0.32 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 75.52 110.851 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.9 p -143.88 128.52 14.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 74.24 111.114 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -48.42 129.63 16.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 73.31 110.861 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.404 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 178.05 81.15 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.74 -0.743 . . . . 74.04 112.545 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.404 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.8 146.22 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.843 0.354 . . . . 74.44 111.13 -179.951 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.32 -165.48 1.59 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.138 -0.483 . . . . 73.34 110.912 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -94.24 118.21 31.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.305 -0.407 . . . . 75.12 110.92 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.1 mm -109.87 90.99 10.02 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.593 0.711 . . . . 74.22 111.158 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.84 96.29 0.59 Allowed 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.704 2.269 . . . . 72.51 112.26 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -63.18 -36.44 83.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 75.53 110.964 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.455 ' HB ' ' HA ' ' A' ' 26' ' ' LYS . 58.8 m -129.33 151.43 49.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.109 -0.496 . . . . 63.33 111.117 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -146.1 40.37 1.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 73.4 110.869 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 5.7 mtt85 -125.21 -57.37 1.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 75.55 110.856 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -145.52 -39.21 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.803 -0.713 . . . . 64.21 112.501 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.19 40.8 1.45 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.826 0.346 . . . . 74.34 110.863 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.455 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 0.7 OUTLIER -51.03 115.16 1.4 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 73.32 110.9 179.924 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.8 t -128.98 94.87 3.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.254 -0.43 . . . . 73.42 111.154 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 48.3 t -78.3 127.61 38.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 73.31 111.13 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.414 ' O ' ' C ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -84.39 51.68 2.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.124 -0.489 . . . . 73.25 110.852 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 29' ' ' LEU . 35.5 mttp -37.4 107.51 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.256 -0.429 . . . . 75.42 110.871 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.19 48.11 0.4 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.743 -0.741 . . . . 73.35 112.506 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.7 mm -108.07 92.38 2.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.842 0.353 . . . . 74.32 111.181 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.8 153.52 38.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 61.35 110.863 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.64 -108.62 0.31 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.774 -0.727 . . . . 62.31 112.459 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.539 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 48.8 mt -156.74 86.24 0.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.879 0.371 . . . . 73.12 110.898 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -160.83 162.79 32.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 74.34 110.858 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.0 t -164.7 -39.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.082 -0.508 . . . . 73.4 110.924 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 5.5 p -129.86 -44.13 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 75.2 111.123 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.401 ' HB3' ' HA3' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -90.79 169.81 10.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.203 -0.453 . . . . 71.53 110.784 179.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.2 p -134.92 6.92 3.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.485 . . . . 74.13 110.931 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -93.73 -65.3 1.0 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.474 . . . . 73.43 110.904 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -75.95 61.4 1.49 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 65.02 110.902 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.9 p -100.64 158.59 15.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 74.12 110.835 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 20.8 mm -142.81 140.01 27.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.149 -0.478 . . . . 74.12 111.114 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.7 mtt -143.75 133.88 24.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 73.43 110.889 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.3 m-20 -86.19 -169.87 2.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 64.13 110.869 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.87 -59.12 5.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 74.35 110.909 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -53.79 -56.53 16.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 75.02 110.926 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.29 -59.56 4.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.074 -0.512 . . . . 73.14 110.944 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.5 t -54.17 -39.38 66.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.486 . . . . 73.11 110.867 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.8 -45.47 89.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.128 -0.487 . . . . 72.14 110.857 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.81 -58.96 4.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.193 -0.458 . . . . 74.22 111.137 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -53.99 -47.8 71.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.189 -0.46 . . . . 75.51 110.899 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -48.77 76.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.131 -0.486 . . . . 72.25 110.901 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.25 -41.77 63.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 64.21 111.05 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -70.19 -66.62 0.57 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 74.14 110.886 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 13.5 m -47.32 -35.3 3.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 74.13 111.164 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.3 mmmt -70.29 -52.35 23.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 73.22 110.888 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.48 -50.77 59.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.251 -0.431 . . . . 72.22 111.138 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -65.14 -47.63 76.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.438 . . . . 75.13 110.834 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.11 -51.75 40.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.132 -0.485 . . . . 73.13 110.895 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.78 -54.76 34.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 75.13 111.08 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.19 -42.53 40.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 54.3 110.796 -179.712 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 37.5 t -76.56 -27.32 17.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.435 . . . . 72.52 111.143 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 74.43 110.916 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 17.2 m . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.889 0.376 . . . . 73.32 111.126 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -106.3 156.93 36.08 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.589 0.709 . . . . 64.23 111.131 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.83 -7.95 22.38 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.699 2.266 . . . . 72.52 112.314 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.32 -34.68 10.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.446 . . . . 71.53 110.822 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -58.93 -61.15 2.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 71.33 110.864 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -43.91 -66.39 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.21 111.145 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.1 m -50.95 -38.64 18.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 75.25 111.068 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt -59.54 -47.8 84.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 75.23 110.912 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.5 t -60.78 -39.54 82.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.152 -0.476 . . . . 74.5 111.094 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.2 OUTLIER -62.14 -58.77 6.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 72.44 110.86 -179.936 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -19.97 65.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 74.11 110.865 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.3 ttmm -69.33 -55.83 9.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 71.23 110.853 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.1 mt -91.39 15.12 12.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.267 -0.424 . . . . 75.3 110.914 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 53.4 39.26 29.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 64.43 110.832 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.84 87.09 5.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.137 -0.483 . . . . 74.32 110.921 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.39 156.74 0.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.162 -0.472 . . . . 70.51 111.178 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -58.78 -21.47 55.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 75.24 110.902 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.47 -54.19 6.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 75.15 110.917 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.48 -53.15 60.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 72.55 110.921 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.57 -32.46 28.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.083 -0.508 . . . . 73.15 111.077 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 4.3 m -80.72 -34.44 34.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.296 -0.411 . . . . 64.13 110.856 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -76.26 -21.61 56.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.101 -0.499 . . . . 73.53 110.868 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 40.6 mt -105.65 -62.22 2.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.446 . . . . 75.43 111.113 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -75.69 -63.22 1.35 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 75.43 110.897 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 115.54 48.72 0.5 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.736 -0.745 . . . . 63.14 112.516 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -70.37 -37.06 70.15 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.738 -0.744 . . . . 41.52 112.453 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 103.87 -160.0 16.37 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.743 -0.742 . . . . 74.32 112.464 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.8 t -76.7 -69.93 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.927 0.394 . . . . 63.43 111.14 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -85.37 44.09 1.07 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.467 . . . . 71.14 110.893 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -59.05 -75.58 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 74.33 111.09 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.403 ' C ' ' O ' ' A' ' 98' ' ' ALA . 36.6 m-85 -37.75 -43.26 0.64 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.216 -0.447 . . . . 75.24 110.924 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.2 t -58.31 -75.86 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 74.31 110.859 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 20.9 mtt180 -49.45 -49.24 46.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 75.44 110.851 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -53.0 -36.21 60.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 73.52 110.916 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -52.72 -36.29 57.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 74.53 110.856 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.79 -19.6 16.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 74.44 110.903 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.78 24.46 13.35 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.768 -0.73 . . . . 73.05 112.507 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -95.58 -5.78 41.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.803 0.335 . . . . 71.42 110.876 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -115.02 17.43 16.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 43.5 111.133 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.471 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -129.49 56.03 21.86 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.603 0.716 . . . . 71.15 110.889 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.492 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.6 Cg_endo -69.75 38.67 0.26 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.734 2.289 . . . . 75.43 112.339 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.745 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER 72.05 34.21 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.547 0.689 . . . . 74.34 110.849 179.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.745 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.1 Cg_endo -69.81 -164.5 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.632 2.222 . . . . 74.13 112.34 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 4.1 p -88.94 -27.15 21.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.138 -0.483 . . . . 63.14 110.932 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 8.3 m -56.94 -49.85 74.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.058 -0.519 . . . . 73.42 111.121 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 36.5 mm -47.5 -45.75 10.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 75.11 111.169 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.39 -46.98 77.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.475 . . . . 73.22 110.818 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.454 ' O ' ' HB2' ' A' ' 120' ' ' LEU . 7.8 mp -60.16 -34.15 73.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.273 -0.421 . . . . 74.04 111.002 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 25.4 mt -69.69 -56.79 6.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 73.2 110.907 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -51.0 -34.09 27.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.152 -0.476 . . . . 72.2 110.911 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 18.6 m -87.71 -20.31 7.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.155 -0.475 . . . . 74.33 111.136 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 116' ' ' LEU . 0.5 OUTLIER -75.21 -40.51 59.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.136 -0.484 . . . . 72.21 110.891 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -49.89 -31.42 12.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 72.41 110.825 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -94.99 -21.21 18.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 74.04 110.937 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -131.37 91.69 34.3 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.626 0.727 . . . . 63.5 110.846 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 0.7 5.28 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.699 2.266 . . . . 63.34 112.316 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -114.45 -13.02 12.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.208 -0.451 . . . . 74.54 110.9 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 6.3 tp -53.06 -49.28 66.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.143 -0.481 . . . . 73.41 110.913 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -46.65 -32.55 3.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 64.0 110.956 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.39 -38.44 26.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 73.41 110.929 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -78.09 -7.59 57.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 74.2 110.891 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 7.1 pt -118.73 -17.03 7.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.164 -0.471 . . . . 75.14 111.122 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 73.22 110.903 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.81 0.338 . . . . 71.03 110.858 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.48 ' O ' ' HB2' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -174.69 -170.6 0.5 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 75.44 110.864 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 49.6 t 176.11 59.49 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.613 0.72 . . . . 74.45 110.867 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 1.04 4.82 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.638 2.225 . . . . 74.04 112.328 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.1 m -87.84 -42.63 15.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 73.21 111.136 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.2 t -126.97 -24.33 3.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 74.21 110.918 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.432 ' N ' ' O ' ' A' ' 3' ' ' CYS . 16.2 m-70 62.92 47.67 4.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 72.33 110.785 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -102.25 -75.26 0.6 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 75.22 110.914 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -110.77 -137.95 7.63 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.694 -0.765 . . . . 73.12 112.56 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -144.54 104.48 4.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.85 0.357 . . . . 72.33 110.877 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.532 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -67.43 107.25 2.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 75.52 110.914 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -146.97 130.89 9.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 74.24 111.121 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -47.99 132.24 15.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 73.31 110.895 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.41 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 177.18 79.69 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.751 -0.738 . . . . 74.04 112.514 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.41 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.88 146.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.913 0.387 . . . . 74.44 111.095 -179.941 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.09 -165.72 1.67 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 73.34 110.913 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -94.88 116.73 29.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.241 -0.436 . . . . 75.12 110.91 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.0 mm -107.93 90.74 6.81 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.616 0.722 . . . . 74.22 111.138 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 96.12 0.58 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.706 2.271 . . . . 72.51 112.332 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.0 t80 -64.58 -35.96 82.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 75.53 110.84 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.415 HG22 ' HG2' ' A' ' 25' ' ' ARG . 20.2 m -131.35 152.35 50.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.457 . . . . 63.33 111.16 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -155.29 37.64 0.39 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.257 -0.429 . . . . 73.4 110.935 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.38 -34.0 1.86 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.157 -0.474 . . . . 75.55 110.89 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -156.91 -51.0 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.741 -0.742 . . . . 64.21 112.468 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.415 ' HG2' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -107.71 53.14 0.7 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.859 0.361 . . . . 74.34 110.883 -179.859 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -56.73 121.11 9.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.487 . . . . 73.32 110.909 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.8 t -136.8 92.95 2.79 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.288 -0.415 . . . . 73.42 111.144 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 45.8 t -77.3 128.12 38.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 73.31 111.151 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.401 ' O ' ' C ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -84.67 51.88 2.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.188 -0.46 . . . . 73.25 110.908 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.401 ' C ' ' O ' ' A' ' 29' ' ' LEU . 30.5 mttp -37.25 107.24 0.06 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 75.42 110.903 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.7 50.03 0.37 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.797 -0.716 . . . . 73.35 112.526 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 19.1 mm -109.46 92.65 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.894 0.378 . . . . 74.32 111.18 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.42 154.0 37.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 61.35 110.843 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.64 -108.46 0.31 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.78 -0.724 . . . . 62.31 112.497 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.532 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 61.0 mt -156.67 86.16 0.99 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.85 0.357 . . . . 73.12 110.986 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -161.45 164.3 29.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.15 -0.477 . . . . 74.34 110.923 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 9.9 t -169.29 -44.33 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 73.4 110.835 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.0 m -120.69 -47.41 2.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 75.2 111.148 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.88 172.71 8.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 71.53 110.895 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.8 t -138.15 9.86 2.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.425 . . . . 74.13 110.951 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -97.91 -63.31 1.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 73.43 110.929 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -76.66 60.59 1.7 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.14 -0.482 . . . . 65.02 110.933 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.9 p -98.3 158.65 15.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 74.12 110.854 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 18.3 mm -144.31 139.39 24.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 74.12 111.169 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.8 mtt -142.06 137.51 31.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.192 -0.458 . . . . 73.43 110.975 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 40.9 m-20 -89.05 -169.52 2.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 64.13 110.887 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? -54.78 -59.8 4.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 74.35 110.857 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -56.84 13.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 75.02 110.905 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.02 -59.43 4.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.105 -0.498 . . . . 73.14 110.92 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.9 t -53.62 -41.23 66.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.127 -0.488 . . . . 73.11 110.89 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -57.6 -45.23 85.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 72.14 110.876 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.62 -61.04 2.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 74.22 111.084 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -52.49 -48.37 65.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 75.51 110.92 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -49.32 76.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 72.25 110.842 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.43 -41.71 61.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 64.21 111.068 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -70.18 -67.38 0.5 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.449 . . . . 74.14 110.89 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.0 m -46.98 -35.74 3.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 74.13 111.142 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -69.52 -54.25 15.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 73.22 110.92 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.25 -51.75 31.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 72.22 111.124 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.66 -49.13 74.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.167 -0.47 . . . . 75.13 110.876 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.65 -36.68 36.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.043 -0.526 . . . . 73.13 110.805 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.12 -54.01 9.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.292 -0.413 . . . . 75.13 111.06 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.29 -28.57 65.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 54.3 110.837 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 19.9 m -94.14 -17.38 7.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.147 -0.479 . . . . 72.52 111.185 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 74.43 110.935 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 17.0 m . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.812 0.339 . . . . 73.32 111.054 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -105.92 155.45 38.32 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.52 0.676 . . . . 64.23 111.08 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.68 -6.93 19.74 Favored 'Trans proline' 0 N--CA 1.465 -0.156 0 C-N-CA 122.708 2.272 . . . . 72.52 112.355 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.06 -34.78 9.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 71.53 110.905 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -58.34 -61.83 2.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 71.33 110.834 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -39.54 -69.98 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.15 -0.477 . . . . 74.21 111.105 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.9 m -49.37 -39.81 13.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 75.25 111.136 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.5 mtmt -61.46 -38.29 86.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.152 -0.476 . . . . 75.23 110.894 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 16.6 t -69.81 -38.15 75.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.245 -0.434 . . . . 74.5 111.123 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.93 -33.33 72.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.138 -0.483 . . . . 72.44 110.866 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -88.05 -21.83 24.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.149 -0.478 . . . . 74.11 110.924 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -74.16 -50.5 19.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.204 -0.453 . . . . 71.23 110.897 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 12.8 mt -89.71 12.05 18.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.244 -0.434 . . . . 75.3 111.003 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 65.3 m 53.14 39.8 30.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.149 -0.478 . . . . 64.43 110.888 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -79.56 83.99 5.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.125 -0.489 . . . . 74.32 110.891 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.43 157.3 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.16 -0.473 . . . . 70.51 111.164 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -56.29 -23.19 35.07 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.245 -0.434 . . . . 75.24 110.921 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.4 mmtp -80.0 -47.1 15.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 75.15 110.916 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -67.22 -56.25 10.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.271 -0.422 . . . . 72.55 110.827 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -50.79 -38.67 49.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 73.15 111.045 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 96.6 p -77.53 -32.3 53.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 64.13 110.86 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -73.72 -28.86 61.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 73.53 110.925 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 11.4 mm -99.92 -63.59 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 75.43 111.192 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -70.08 -61.57 1.73 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.128 -0.487 . . . . 75.43 110.863 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 111.95 41.66 1.07 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.755 -0.736 . . . . 63.14 112.458 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -57.83 -44.95 94.07 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.698 -0.763 . . . . 41.52 112.495 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.69 -151.2 16.95 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.799 -0.715 . . . . 74.32 112.505 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.0 t -85.41 -69.1 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.822 0.344 . . . . 63.43 111.104 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -83.33 39.58 0.67 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 71.14 110.876 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.21 -79.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.119 -0.491 . . . . 74.33 111.112 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -37.68 -43.07 0.61 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.343 -0.39 . . . . 75.24 110.874 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.0 -76.45 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 74.31 110.833 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 55.7 mtt180 -50.09 -49.46 51.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 75.44 110.897 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -51.17 -37.35 45.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.241 -0.436 . . . . 73.52 110.88 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -51.22 -38.33 51.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 74.53 110.871 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.95 -18.56 17.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.105 -0.498 . . . . 74.44 110.902 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.94 26.32 11.71 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.723 -0.751 . . . . 73.05 112.539 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -96.37 -4.18 42.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.892 0.377 . . . . 71.42 110.911 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -120.69 18.4 11.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 43.5 111.093 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.477 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -126.28 55.91 14.9 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.661 0.743 . . . . 71.15 110.932 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.472 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.4 Cg_endo -69.74 36.51 0.23 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.698 2.266 . . . . 75.43 112.327 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.743 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 4.7 t-160 71.67 34.27 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.576 0.703 . . . . 74.34 110.881 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.743 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.3 Cg_endo -69.79 -164.26 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.648 2.232 . . . . 74.13 112.33 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 28.3 t -83.64 -30.82 26.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.145 -0.48 . . . . 63.14 110.876 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 54.1 m -54.94 -50.68 68.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.108 -0.496 . . . . 73.42 111.102 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 44.0 mm -54.21 -47.75 67.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 75.11 111.13 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -28.59 70.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.462 . . . . 73.22 110.968 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.4 ' HG ' HD13 ' A' ' 130' ' ' ILE . 5.1 mp -79.59 -42.01 25.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 74.04 110.932 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.424 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 4.4 mt -61.48 -48.55 80.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 73.2 110.917 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 15.9 ptp180 -54.06 -35.32 61.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 72.2 110.867 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 34.5 m -92.97 -10.65 9.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 74.33 111.159 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.7 OUTLIER -83.42 -39.98 19.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 72.21 110.898 179.971 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -50.33 -31.68 15.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 72.41 110.859 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.16 -19.66 19.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 74.04 110.938 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 -130.82 90.39 40.13 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.558 0.694 . . . . 63.5 110.876 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 0.39 5.69 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.664 2.243 . . . . 63.34 112.289 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -113.93 -11.91 12.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.248 -0.433 . . . . 74.54 110.874 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 6.7 tp -53.95 -47.87 70.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 73.41 110.892 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.431 ' HA ' HG12 ' A' ' 130' ' ' ILE . 2.0 pt? -51.0 -28.76 10.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 64.0 110.985 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . 0.467 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.68 -27.21 23.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 73.41 110.892 179.9 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -94.31 2.48 55.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.475 . . . . 74.2 110.839 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . 0.431 HG12 ' HA ' ' A' ' 127' ' ' LEU . 13.5 pt -121.12 -33.99 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 75.14 111.174 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.467 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 2.3 ptt-85 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 73.22 110.911 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.6 mmt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.877 0.37 . . . . 71.03 110.916 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.77 -169.35 0.41 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 75.44 110.902 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.4 ' O ' ' N ' ' A' ' 7' ' ' HIS . 1.6 t -179.44 58.6 0.1 Allowed Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.572 0.701 . . . . 74.45 110.861 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 3.15 2.95 Favored 'Trans proline' 0 N--CA 1.465 -0.2 0 C-N-CA 122.72 2.28 . . . . 74.04 112.389 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.6 m -107.58 -45.71 7.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.199 -0.455 . . . . 73.21 111.077 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -106.92 -33.47 7.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 74.21 110.947 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.4 ' N ' ' O ' ' A' ' 3' ' ' CYS . 58.6 m-70 59.48 24.85 13.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.14 -0.482 . . . . 72.33 110.827 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -92.14 -67.22 0.87 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 75.22 110.991 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.74 -135.32 6.36 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.729 -0.748 . . . . 73.12 112.477 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -145.62 95.23 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.841 0.353 . . . . 72.33 110.913 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.509 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.5 OUTLIER -59.67 104.91 0.32 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.221 -0.445 . . . . 75.52 110.889 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 8.8 p -145.9 133.04 14.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.43 . . . . 74.24 111.145 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -49.25 132.75 19.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.178 -0.464 . . . . 73.31 110.868 -179.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.426 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 178.09 77.58 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.752 -0.737 . . . . 74.04 112.483 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.426 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -35.65 143.8 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.91 0.386 . . . . 74.44 111.094 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.31 -168.15 2.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.132 -0.485 . . . . 73.34 110.912 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -93.27 116.08 28.66 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.22 -0.445 . . . . 75.12 110.88 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.454 ' O ' ' HA ' ' A' ' 28' ' ' VAL . 8.6 mm -107.68 91.35 7.24 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.654 0.74 . . . . 74.22 111.098 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.435 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.8 105.1 1.43 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.716 2.277 . . . . 72.51 112.306 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -70.69 -29.64 66.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.993 0.425 . . . . 75.53 110.932 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 24.3 m -130.74 146.36 52.19 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.114 -0.493 . . . . 63.33 111.231 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -140.17 48.23 1.78 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 73.4 110.908 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.16 -69.03 0.57 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 75.55 110.847 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -134.56 -40.45 0.17 Allowed Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.746 -0.74 . . . . 64.21 112.428 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.95 39.61 1.52 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.901 0.381 . . . . 74.34 110.897 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.1 tttt -49.33 109.65 0.29 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 73.32 110.86 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.2 t -128.08 92.27 3.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.275 -0.42 . . . . 73.42 111.127 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 0.8 OUTLIER -80.33 140.12 17.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 73.31 111.15 179.865 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.421 ' O ' HG12 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -86.53 63.34 7.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 73.25 110.955 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.9 mttp -41.46 105.56 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 75.42 110.858 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 115.5 62.1 0.37 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.653 -0.784 . . . . 73.35 112.398 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.421 HG12 ' O ' ' A' ' 29' ' ' LEU . 19.4 mm -118.31 92.3 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.852 0.358 . . . . 74.32 111.151 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.12 153.25 39.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 61.35 110.827 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 168.22 -109.63 0.35 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.751 -0.738 . . . . 62.31 112.497 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.509 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 61.4 mt -156.82 85.81 0.97 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.89 0.376 . . . . 73.12 110.892 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -158.75 163.35 36.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.161 -0.472 . . . . 74.34 110.895 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -168.38 -47.27 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.068 -0.515 . . . . 73.4 110.93 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.2 m -120.54 -47.05 2.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 75.2 111.186 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -87.45 169.42 12.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.167 -0.469 . . . . 71.53 110.849 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.4 m -136.84 15.15 3.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 74.13 110.892 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -103.79 -62.88 1.25 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.157 -0.474 . . . . 73.43 110.925 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -77.14 61.91 2.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 65.02 110.891 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.3 p -98.03 155.64 17.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.491 . . . . 74.12 110.923 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 21.0 mm -141.84 140.45 30.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.466 . . . . 74.12 111.135 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.8 mtt -144.53 134.79 24.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 73.43 110.884 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.3 m-20 -81.93 -169.85 2.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 64.13 110.851 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.06 -60.1 4.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 74.35 110.934 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -51.76 -57.44 9.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.275 -0.42 . . . . 75.02 110.899 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.42 -58.75 5.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 73.14 110.912 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.9 t -53.74 -38.88 64.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 73.11 110.821 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.75 -43.99 97.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.096 -0.502 . . . . 72.14 110.904 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.83 -58.34 6.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 74.22 111.069 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -54.42 -47.3 72.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.257 -0.429 . . . . 75.51 110.869 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.82 -50.44 68.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.131 -0.486 . . . . 72.25 110.857 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.5 -41.2 60.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 64.21 111.107 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.417 ' HB2' ' HG ' ' A' ' 29' ' ' LEU . 3.4 mt-30 -69.97 -66.99 0.52 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 74.14 110.946 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.1 m -47.82 -35.51 4.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 74.13 111.092 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -69.05 -54.43 15.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 73.22 110.87 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.62 -52.44 39.48 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 72.22 111.134 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.48 -44.69 90.23 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.449 . . . . 75.13 110.893 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.0 mtt-85 -50.7 -51.63 47.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.158 -0.473 . . . . 73.13 110.933 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.69 -54.14 36.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 75.13 111.044 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.62 -38.58 32.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 54.3 110.878 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 44.4 t -82.4 -25.99 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 72.52 111.121 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.159 -0.473 . . . . 74.43 110.867 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 17.6 m . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.828 0.347 . . . . 73.32 111.136 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -103.14 153.73 38.15 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.541 0.686 . . . . 64.23 111.021 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.67 -7.69 21.68 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.685 2.257 . . . . 72.52 112.367 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -98.85 -36.31 9.83 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.201 -0.454 . . . . 71.53 110.852 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -57.76 -61.13 2.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.194 -0.457 . . . . 71.33 110.896 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.4 ' O ' ' HG3' ' A' ' 78' ' ' ARG . 0.3 OUTLIER -40.01 -70.47 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 74.21 111.17 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.7 m -48.85 -38.87 10.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.151 -0.477 . . . . 75.25 111.205 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.6 mtmt -62.77 -39.05 92.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 75.23 110.802 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 39.3 t -68.07 -38.07 79.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.268 -0.424 . . . . 74.5 111.121 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' A' ' 74' ' ' ILE . 0.7 OUTLIER -70.33 -36.51 74.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 72.44 110.851 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -84.08 -20.84 31.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.169 -0.469 . . . . 74.11 110.895 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.5 ttmt -75.59 -50.19 16.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 71.23 110.87 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 12.9 mt -90.19 12.22 18.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 75.3 110.918 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.3 t 52.47 40.8 30.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 64.43 110.851 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -79.13 84.61 5.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 74.32 110.864 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.29 156.33 0.11 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 70.51 111.131 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -58.33 -24.7 60.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 75.24 110.9 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -77.08 -49.01 16.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 75.15 110.945 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.98 -54.83 13.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.226 -0.443 . . . . 72.55 110.919 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.69 -35.35 42.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 73.15 111.104 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.2 m -78.67 -37.07 42.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 64.13 110.892 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -72.76 -24.79 61.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.128 -0.487 . . . . 73.53 110.82 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 51.9 mt -101.47 -64.09 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 75.43 111.112 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -71.72 -61.26 1.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 75.43 110.975 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.65 45.01 1.0 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.796 -0.716 . . . . 63.14 112.458 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -66.59 -46.62 74.9 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.751 -0.738 . . . . 41.52 112.564 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.49 172.54 21.45 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.717 -0.754 . . . . 74.32 112.5 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -50.9 -66.64 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.869 0.366 . . . . 63.43 111.099 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -86.24 42.23 0.98 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.155 -0.475 . . . . 71.14 110.882 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.13 -76.18 0.06 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 74.33 111.145 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -39.66 -40.32 0.89 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 75.24 110.866 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.9 m -59.93 -76.28 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.163 -0.471 . . . . 74.31 110.89 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 24.6 mtt85 -49.93 -45.66 51.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.102 -0.499 . . . . 75.44 110.885 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -56.96 -36.57 70.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 73.52 110.943 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 -59.81 -25.98 65.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.104 -0.498 . . . . 74.53 110.891 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.11 -20.5 14.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 74.44 110.903 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.15 28.38 11.9 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.742 -0.742 . . . . 73.05 112.564 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 60.1 m-20 -104.35 -8.65 19.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.819 0.342 . . . . 71.42 110.926 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -114.52 15.14 17.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 43.5 111.12 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.473 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -127.04 54.6 12.63 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.529 0.68 . . . . 71.15 110.904 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.479 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.0 Cg_endo -69.75 37.03 0.24 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.642 2.228 . . . . 75.43 112.347 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.748 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.5 t-160 71.9 34.06 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.65 0.738 . . . . 74.34 110.856 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.748 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.4 Cg_endo -69.77 -164.07 0.12 Allowed 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.665 2.243 . . . . 74.13 112.412 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.94 -32.77 30.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.311 -0.404 . . . . 63.14 110.874 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 21.0 m -52.3 -55.35 21.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.476 . . . . 73.42 111.176 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 42.7 mm -50.94 -46.55 30.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 75.11 111.116 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -28.53 69.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 73.22 110.894 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 5.8 mp -81.29 -47.5 13.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.265 -0.425 . . . . 74.04 110.922 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.406 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 21.5 mt -55.91 -47.75 76.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.47 . . . . 73.2 110.995 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -54.91 -35.6 64.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 72.2 110.915 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 31.7 m -95.7 -3.46 10.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 74.33 111.145 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.406 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.4 OUTLIER -89.68 -40.73 12.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 72.21 110.909 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -49.31 -32.43 11.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.256 -0.429 . . . . 72.41 110.849 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.47 -20.53 18.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 74.04 110.856 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 48.0 m-70 -127.36 87.34 56.53 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.602 0.715 . . . . 63.5 110.865 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.73 3.9 2.49 Favored 'Trans proline' 0 C--N 1.341 0.14 0 C-N-CA 122.747 2.298 . . . . 63.34 112.338 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -117.91 -12.42 10.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 74.54 110.897 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.7 tp -53.6 -48.09 69.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 73.41 110.958 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -46.33 -32.75 3.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 64.0 110.922 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -81.96 -38.08 25.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 73.41 110.927 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.72 -5.72 53.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.479 . . . . 74.2 110.892 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 8.7 pt -118.14 -22.26 4.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.152 -0.476 . . . . 75.14 111.133 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.193 -0.458 . . . . 73.22 110.889 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mtt . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.838 0.352 . . . . 71.03 110.879 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.24 -171.21 0.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.192 -0.458 . . . . 75.44 110.906 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.403 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 0.5 OUTLIER 175.79 56.72 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.651 0.739 . . . . 74.45 110.96 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 53.3 Cg_endo -69.73 2.39 3.56 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.724 2.282 . . . . 74.04 112.327 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.89 -44.6 11.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.448 . . . . 73.21 111.144 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 7' ' ' HIS . 0.1 OUTLIER -112.2 -40.01 4.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.169 -0.469 . . . . 74.21 110.894 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.414 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 24.6 m-70 69.29 51.63 0.5 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 72.33 110.854 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -120.31 -71.95 0.71 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 75.22 110.949 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -99.61 -121.38 4.6 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.669 -0.776 . . . . 73.12 112.556 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -169.29 87.52 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.804 0.335 . . . . 72.33 110.938 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.488 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -46.04 105.71 0.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 75.52 110.869 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.9 p -144.57 129.2 13.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 74.24 111.148 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.6 p -47.5 126.23 9.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 73.31 110.89 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.88 80.99 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.692 -0.766 . . . . 74.04 112.429 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -37.27 147.24 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.88 0.371 . . . . 74.44 111.097 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.32 -165.32 1.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 73.34 110.899 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -96.54 117.34 30.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.262 -0.426 . . . . 75.12 110.851 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.7 mm -108.05 91.3 7.68 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.639 0.733 . . . . 74.22 111.146 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.7 96.26 0.58 Allowed 'Trans proline' 0 N--CA 1.464 -0.217 0 C-N-CA 122.754 2.302 . . . . 72.51 112.38 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -64.29 -34.61 78.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 75.53 110.926 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.412 HG23 ' HG2' ' A' ' 25' ' ' ARG . 17.5 m -130.29 146.89 51.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 63.33 111.155 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -144.63 43.49 1.37 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 73.4 110.917 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.28 -39.64 1.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 75.55 110.802 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -160.48 -53.23 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.736 -0.745 . . . . 64.21 112.495 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.412 ' HG2' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.75 42.44 1.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.867 0.365 . . . . 74.34 110.925 -179.897 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 15.1 tttm -49.77 117.47 2.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 73.32 110.893 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 t -128.91 91.04 3.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 73.42 111.08 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 43.0 t -76.62 126.7 37.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.232 -0.44 . . . . 73.31 111.132 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.77 51.78 2.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 73.25 110.913 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -38.59 107.47 0.07 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 75.42 110.922 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.24 46.09 0.38 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.755 -0.736 . . . . 73.35 112.5 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 13.4 mm -107.37 89.98 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.923 0.392 . . . . 74.32 111.146 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.33 156.43 38.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 61.35 110.875 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.13 -107.39 0.28 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.721 -0.752 . . . . 62.31 112.456 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.488 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 55.6 mt -156.27 82.47 0.99 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.896 0.379 . . . . 73.12 110.87 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -164.88 166.23 19.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.46 . . . . 74.34 110.91 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.5 -34.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 73.4 110.85 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.3 m -121.34 -45.28 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 75.2 111.087 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -98.94 176.02 5.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 71.53 110.856 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.5 p -141.25 28.81 1.84 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.205 -0.452 . . . . 74.13 110.85 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -110.49 -65.68 1.14 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.173 -0.467 . . . . 73.43 110.922 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -76.56 62.29 1.9 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 65.02 110.937 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.1 p -93.05 138.62 31.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 74.12 110.874 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 13.3 mm -135.71 138.91 47.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.086 -0.507 . . . . 74.12 111.115 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 15.2 mtt -139.3 143.19 37.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 73.43 110.854 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.6 m-20 -90.82 -168.91 2.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 64.13 110.844 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.17 -60.41 3.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.131 -0.486 . . . . 74.35 110.996 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.92 -58.24 7.61 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.139 -0.482 . . . . 75.02 110.9 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -50.5 -59.35 4.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 73.14 110.915 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.0 t -52.45 -42.91 64.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 73.11 110.78 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -57.38 -43.38 83.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.152 -0.476 . . . . 72.14 110.842 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.45 -61.93 1.82 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 74.22 111.113 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -52.56 -45.84 66.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.179 -0.464 . . . . 75.51 110.887 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.2 -50.41 68.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 72.25 110.842 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.21 -41.73 60.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.303 -0.408 . . . . 64.21 111.153 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -70.64 -66.99 0.53 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 74.14 110.93 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.3 m -47.03 -35.64 3.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.257 -0.429 . . . . 74.13 111.094 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 11.0 mmmm -70.31 -51.91 26.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 73.22 110.939 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.4 -52.32 46.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.47 . . . . 72.22 111.14 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -65.29 -46.24 81.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 75.13 110.883 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -49.88 -52.49 32.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.104 -0.498 . . . . 73.13 110.866 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.82 -54.54 33.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 75.13 111.094 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.69 -42.05 33.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 54.3 110.836 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 42.9 t -77.15 -28.49 16.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.164 -0.471 . . . . 72.52 111.142 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 74.43 110.853 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 17.0 m . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.912 0.387 . . . . 73.32 111.049 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -104.92 158.17 32.61 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.547 0.689 . . . . 64.23 111.075 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 -8.15 22.88 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.604 2.202 . . . . 72.52 112.42 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -97.81 -34.87 10.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 71.53 110.797 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -57.5 -61.12 2.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.454 . . . . 71.33 110.9 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -44.82 -68.04 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 74.21 111.104 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -48.66 -38.88 10.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 75.25 111.177 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.8 mtmt -61.14 -45.5 94.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.456 . . . . 75.23 110.935 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.5 t -62.03 -39.48 83.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 74.5 111.112 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -58.65 6.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 72.44 110.854 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -24.1 67.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 74.11 110.979 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.2 ttmt -67.97 -53.67 24.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 71.23 110.879 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 10.9 mt -90.68 12.79 17.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.192 -0.458 . . . . 75.3 110.947 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.3 t 53.5 38.41 28.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.117 -0.492 . . . . 64.43 110.915 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -79.58 87.04 5.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.127 -0.488 . . . . 74.32 110.943 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.55 157.4 0.1 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 70.51 111.115 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -57.55 -21.49 38.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 75.24 110.921 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -81.16 -49.21 11.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 75.15 110.957 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -62.47 -54.31 42.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.448 . . . . 72.55 110.863 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.72 -35.8 64.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.483 . . . . 73.15 111.083 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 91.5 p -79.68 -26.11 41.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 64.13 110.832 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.93 -25.88 34.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.469 . . . . 73.53 110.873 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 24.5 mm -103.35 -59.05 3.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.157 -0.474 . . . . 75.43 111.17 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -75.77 -60.96 2.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 75.43 110.87 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.3 49.44 0.76 Allowed Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.711 -0.756 . . . . 63.14 112.527 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.79 -37.39 34.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 41.52 112.509 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 102.11 165.71 26.8 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.685 -0.769 . . . . 74.32 112.467 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.9 p -51.4 -50.67 27.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.832 0.348 . . . . 63.43 111.15 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -86.93 37.73 0.77 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 71.14 110.928 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.46 -76.43 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 74.33 111.11 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -43.25 -39.97 3.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 75.24 110.893 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.37 -75.38 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 74.31 110.876 -179.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 44.6 mtt180 -49.92 -45.02 50.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.075 -0.512 . . . . 75.44 110.892 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -56.35 -37.54 70.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 73.52 110.909 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -53.35 -27.43 23.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.075 -0.511 . . . . 74.53 110.892 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.56 -22.2 12.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 74.44 110.9 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.23 28.16 9.43 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.77 -0.729 . . . . 73.05 112.48 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 65.3 m-20 -100.36 -6.87 25.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.362 . . . . 71.42 110.915 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -109.74 10.68 24.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.189 -0.46 . . . . 43.5 111.101 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.492 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -125.61 56.96 16.11 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.585 0.707 . . . . 71.15 110.96 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.507 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.8 Cg_endo -69.75 36.38 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.698 2.265 . . . . 75.43 112.317 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.773 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.6 t60 73.89 32.33 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.646 0.736 . . . . 74.34 110.865 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.773 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 52.9 Cg_endo -69.8 -163.98 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.721 2.281 . . . . 74.13 112.301 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.0 p -86.94 -28.95 22.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.235 -0.439 . . . . 63.14 110.87 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 22.0 m -53.5 -51.38 62.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.162 -0.472 . . . . 73.42 111.17 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 38.9 mm -51.26 -42.52 26.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 75.11 111.105 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.44 -29.92 69.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.154 -0.475 . . . . 73.22 110.915 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.7 mp -79.23 -41.72 27.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.456 . . . . 74.04 110.922 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.461 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 13.8 mt -63.66 -49.51 72.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 73.2 110.902 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 14.5 ptp180 -52.07 -35.7 48.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 72.2 110.882 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 31.0 m -92.57 -14.07 8.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 74.33 111.099 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.5 OUTLIER -77.04 -39.64 49.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.268 -0.424 . . . . 72.21 110.874 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -50.44 -31.44 15.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.174 -0.466 . . . . 72.41 110.871 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -95.8 -19.86 19.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 74.04 110.966 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -131.41 90.07 38.92 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.589 0.709 . . . . 63.5 110.801 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.71 0.13 6.05 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.745 2.297 . . . . 63.34 112.324 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -113.8 -11.95 12.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 74.54 110.882 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 6.3 tp -53.6 -47.84 69.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.118 -0.492 . . . . 73.41 110.96 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.429 ' HA ' HG12 ' A' ' 130' ' ' ILE . 2.2 pt? -51.1 -29.0 11.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.12 -0.491 . . . . 64.0 110.968 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . 0.465 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.67 -26.07 24.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.174 -0.466 . . . . 73.41 110.906 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -95.88 3.31 53.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 74.2 110.917 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . 0.429 HG12 ' HA ' ' A' ' 127' ' ' LEU . 12.8 pt -122.25 -34.52 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 75.14 111.093 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.465 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.3 ptt-85 . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 73.22 110.84 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mtt . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.884 0.374 . . . . 71.03 110.835 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.63 -169.53 0.43 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.429 . . . . 75.44 110.891 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.5 p 176.88 57.17 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.623 0.725 . . . . 74.45 110.875 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.79 0.52 5.55 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.715 2.277 . . . . 74.04 112.302 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 2.9 m -91.99 -40.37 12.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 73.21 111.2 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 7' ' ' HIS . 0.0 OUTLIER -122.9 -36.33 2.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 74.21 110.858 179.981 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.413 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 24.0 m-70 70.49 61.84 0.21 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 72.33 110.844 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -127.8 -77.15 0.57 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 75.22 110.96 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.404 ' HA3' ' HB3' ' A' ' 39' ' ' HIS . . . -94.43 -118.02 2.98 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.785 -0.722 . . . . 73.12 112.478 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -177.45 96.57 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.905 0.383 . . . . 72.33 110.935 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.432 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -48.36 103.74 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 75.52 110.89 -179.974 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.1 p -141.71 125.11 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 74.24 111.117 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 p -46.66 128.55 10.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.256 -0.429 . . . . 73.31 110.909 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.423 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . -179.7 79.94 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.722 -0.751 . . . . 74.04 112.47 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.423 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.42 146.16 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.905 0.383 . . . . 74.44 111.151 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.8 -166.3 1.96 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 73.34 110.906 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -94.63 119.73 33.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 75.12 110.825 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.3 mm -110.78 92.15 13.97 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.596 0.713 . . . . 74.22 111.181 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.67 94.87 0.53 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.696 2.264 . . . . 72.51 112.369 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -60.75 -39.02 87.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 75.53 110.961 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.3 m -130.67 145.12 51.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.072 -0.513 . . . . 63.33 111.153 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 16.4 p90 -136.12 47.49 2.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.231 -0.44 . . . . 73.4 110.938 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.51 -68.58 0.57 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 75.55 110.89 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.07 -44.88 0.1 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.746 -0.74 . . . . 64.21 112.494 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.79 40.37 1.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.907 0.384 . . . . 74.34 110.92 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -53.92 124.22 14.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 73.32 110.9 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 t -139.2 94.46 2.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.142 -0.481 . . . . 73.42 111.131 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 45.1 t -76.8 127.4 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 73.31 111.151 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.4 ' O ' ' C ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -84.86 51.57 2.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.172 -0.467 . . . . 73.25 110.916 179.956 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 29' ' ' LEU . 22.0 mttp -38.46 107.22 0.06 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 75.42 110.888 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.52 45.51 0.39 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.767 -0.73 . . . . 73.35 112.487 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 15.2 mm -106.3 91.38 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.854 0.359 . . . . 74.32 111.097 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.0 156.87 37.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 61.35 110.827 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.22 -106.89 0.28 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.79 -0.719 . . . . 62.31 112.518 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.432 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 50.3 mt -156.17 83.35 1.0 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.88 0.372 . . . . 73.12 110.845 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.434 ' CD1' ' N ' ' A' ' 36' ' ' TYR . 0.1 OUTLIER -167.97 161.69 12.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.489 . . . . 74.34 110.909 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.35 -33.61 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.161 -0.472 . . . . 73.4 110.886 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.5 p -118.93 -24.7 3.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 75.2 111.128 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.404 ' HB3' ' HA3' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -126.17 177.96 6.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.166 -0.47 . . . . 71.53 110.809 179.978 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.8 p -138.92 9.95 2.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 74.13 110.885 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -92.98 -66.04 0.95 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 73.43 110.901 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -75.71 60.92 1.33 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.49 . . . . 65.02 110.87 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.9 p -94.19 149.54 21.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.15 -0.477 . . . . 74.12 110.88 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 16.5 mm -144.1 137.95 24.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.481 . . . . 74.12 111.156 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.7 mtt -139.65 143.58 37.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.246 -0.434 . . . . 73.43 110.863 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -97.14 -168.55 1.72 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 64.13 110.853 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.48 -56.32 19.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.116 -0.493 . . . . 74.35 110.926 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -57.0 -58.3 8.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 75.02 110.928 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.68 -60.29 3.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.133 -0.485 . . . . 73.14 110.891 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.2 t -53.37 -39.41 64.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 73.11 110.856 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.69 -45.83 88.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.088 -0.505 . . . . 72.14 110.863 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.86 -59.16 4.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 74.22 111.089 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -53.3 -48.23 68.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.17 -0.468 . . . . 75.51 110.858 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -48.72 77.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 72.25 110.914 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.5 -40.49 62.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 64.21 111.072 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -71.09 -66.63 0.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.147 -0.478 . . . . 74.14 110.884 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.2 m -47.6 -35.16 4.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.171 -0.468 . . . . 74.13 111.096 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -71.19 -52.04 21.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 73.22 110.918 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.47 -49.0 62.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.449 . . . . 72.22 111.129 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -67.0 -48.09 69.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 75.13 110.946 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -49.67 -48.96 49.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 73.13 110.881 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.36 -55.88 13.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.491 . . . . 75.13 111.125 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.54 -40.88 39.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.21 -0.45 . . . . 54.3 110.84 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 36.4 t -80.27 -25.28 11.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 72.52 111.15 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 74.43 110.901 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.87 0.367 . . . . 73.32 111.081 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -81.76 161.14 62.18 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.552 0.691 . . . . 64.23 111.071 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -6.98 19.89 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.706 2.271 . . . . 72.52 112.311 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -99.82 -37.8 8.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 71.53 110.89 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -57.04 -62.17 1.94 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.143 -0.48 . . . . 71.33 110.879 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -43.73 -68.09 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 74.21 111.102 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.5 m -49.08 -39.1 11.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.111 -0.495 . . . . 75.25 111.092 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -61.42 -37.77 84.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 75.23 110.825 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 97.2 t -70.67 -38.39 72.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.274 -0.421 . . . . 74.5 111.127 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.9 OUTLIER -69.83 -33.22 72.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 72.44 110.899 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -89.75 -19.17 25.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 74.11 110.886 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.2 ttmm -75.85 -51.62 12.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.265 -0.425 . . . . 71.23 110.861 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.3 mt -91.49 14.47 14.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.245 -0.434 . . . . 75.3 110.922 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.02 43.19 29.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.439 . . . . 64.43 110.915 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -79.18 86.07 5.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.099 -0.5 . . . . 74.32 110.925 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -46.85 155.8 0.24 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 70.51 111.14 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.61 -22.24 61.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 75.24 110.991 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -77.34 -54.25 6.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 75.15 110.949 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.5 -51.75 57.77 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.181 -0.463 . . . . 72.55 110.969 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.91 -32.68 54.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 73.15 111.021 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 13.7 t -80.34 -35.8 35.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 64.13 110.842 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -75.77 -21.13 57.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.088 -0.506 . . . . 73.53 110.896 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 55.7 mt -104.93 -62.35 2.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 75.43 111.112 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -75.31 -61.58 1.85 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 75.43 110.921 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 113.17 48.16 0.62 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.723 -0.751 . . . . 63.14 112.422 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -69.78 -41.06 74.95 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.732 -0.747 . . . . 41.52 112.436 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 100.87 -155.85 19.27 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.76 -0.733 . . . . 74.32 112.533 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.5 t -80.56 -70.25 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 63.43 111.161 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -84.9 41.24 0.85 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.112 -0.494 . . . . 71.14 110.913 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.61 -73.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 74.33 111.041 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -40.36 -41.68 1.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 75.24 110.871 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -60.1 -75.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 74.31 110.893 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -48.5 -47.9 38.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 75.44 110.886 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -55.02 -37.78 67.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 73.52 110.943 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -53.3 -31.84 45.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 74.53 110.919 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.84 -20.5 14.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.116 -0.493 . . . . 74.44 110.909 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.63 25.41 13.58 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.731 -0.747 . . . . 73.05 112.541 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -98.38 -5.31 32.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.884 0.373 . . . . 71.42 110.909 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -118.02 17.17 14.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 43.5 111.093 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.457 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -126.32 54.01 10.37 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.572 0.701 . . . . 71.15 110.948 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.481 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.2 Cg_endo -69.66 39.79 0.28 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.705 2.27 . . . . 75.43 112.34 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.736 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.3 m170 71.0 35.51 0.09 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.546 0.689 . . . . 74.34 110.898 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.736 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.2 Cg_endo -69.75 -164.05 0.12 Allowed 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.641 2.228 . . . . 74.13 112.353 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.5 m -89.17 -23.84 22.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 63.14 110.831 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 21.1 m -61.49 -45.95 92.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.114 -0.494 . . . . 73.42 111.139 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 44.0 mm -56.35 -43.38 77.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 75.11 111.064 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -33.75 73.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.142 -0.481 . . . . 73.22 110.873 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.416 ' O ' ' HB2' ' A' ' 120' ' ' LEU . 7.5 mp -74.39 -38.12 63.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.235 -0.438 . . . . 74.04 110.918 179.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.412 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 33.7 mt -68.46 -51.42 43.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 73.2 110.974 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -50.33 -34.46 23.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 72.2 110.864 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.7 m -91.75 -19.98 6.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.224 -0.443 . . . . 74.33 111.085 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 116' ' ' LEU . 0.4 OUTLIER -72.78 -44.58 61.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.171 -0.468 . . . . 72.21 110.92 179.963 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -48.54 -29.45 4.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 72.41 110.794 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -91.78 -30.16 16.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.465 . . . . 74.04 110.894 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -128.06 98.37 27.2 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.552 0.692 . . . . 63.5 110.857 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 3.93 2.51 Favored 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.652 2.235 . . . . 63.34 112.357 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -115.2 -12.58 11.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.257 -0.429 . . . . 74.54 110.878 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.1 mt -50.42 -48.53 56.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 73.41 110.924 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' A' ' 131' ' ' ARG . 1.7 pt? -49.67 -29.47 7.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 64.0 110.978 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . 0.452 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.3 m-80 -86.85 -26.9 23.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 73.41 110.902 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -96.89 7.81 45.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 74.2 110.885 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 7.8 pt -128.06 -34.32 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 75.14 111.103 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.452 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 0.9 OUTLIER . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.253 -0.431 . . . . 73.22 110.858 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mmt . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.893 0.378 . . . . 71.03 110.883 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.66 -169.2 0.41 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 75.44 110.893 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.1 p 177.64 58.39 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.641 0.734 . . . . 74.45 110.844 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 1.94 3.95 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.71 2.274 . . . . 74.04 112.348 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 23.8 m -92.78 -37.28 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 73.21 111.184 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -127.26 -33.46 2.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.155 -0.475 . . . . 74.21 110.88 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 66.4 57.67 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 72.33 110.806 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 93.4 mm-40 -121.3 -75.92 0.59 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.224 -0.444 . . . . 75.22 110.914 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -99.09 -114.74 3.55 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.682 -0.771 . . . . 73.12 112.477 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -174.3 98.07 0.1 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.803 0.335 . . . . 72.33 110.866 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.533 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -59.63 107.4 0.59 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.201 -0.454 . . . . 75.52 110.824 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 6.6 p -146.7 127.44 6.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 74.24 111.157 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.8 p -48.61 135.81 14.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.449 . . . . 73.31 110.86 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.435 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 174.41 77.29 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.784 -0.722 . . . . 74.04 112.531 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.435 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.7 OUTLIER -33.71 141.35 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.897 0.379 . . . . 74.44 111.102 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.17 -168.14 2.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.441 . . . . 73.34 110.939 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -93.2 116.25 28.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.271 -0.422 . . . . 75.12 110.913 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.442 ' O ' ' HA ' ' A' ' 28' ' ' VAL . 8.6 mm -107.91 91.27 7.44 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.653 0.739 . . . . 74.22 111.058 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.427 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 54.4 Cg_endo -69.71 103.85 1.22 Allowed 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.688 2.258 . . . . 72.51 112.379 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -68.72 -34.2 75.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 75.53 110.926 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.5 m -128.05 147.37 50.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.107 -0.497 . . . . 63.33 111.077 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -141.62 47.78 1.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 73.4 110.91 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.18 -68.7 0.55 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.116 -0.493 . . . . 75.55 110.863 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -132.32 -42.92 0.17 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.708 -0.758 . . . . 64.21 112.404 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.05 40.46 1.33 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.842 0.353 . . . . 74.34 110.87 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -50.08 113.9 0.97 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 73.32 110.91 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.1 t -134.65 94.76 3.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 73.42 111.151 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.442 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 0.8 OUTLIER -82.15 140.29 16.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 73.31 111.122 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.43 ' HG ' ' HB2' ' A' ' 56' ' ' GLN . 0.2 OUTLIER -86.46 63.32 7.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 73.25 110.983 179.929 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -41.6 105.22 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 75.42 110.852 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 115.37 62.46 0.37 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.737 -0.744 . . . . 73.35 112.516 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 29' ' ' LEU . 19.9 mm -118.05 93.3 2.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.827 0.346 . . . . 74.32 111.147 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.81 152.3 38.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 61.35 110.907 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.58 -109.42 0.34 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.689 -0.767 . . . . 62.31 112.46 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.533 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 51.6 mt -156.76 86.31 0.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.805 0.336 . . . . 73.12 110.881 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -160.77 159.85 30.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 74.34 110.922 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 32.3 t -164.05 -46.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.088 -0.505 . . . . 73.4 110.92 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.0 m -120.37 -47.05 2.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.198 -0.455 . . . . 75.2 111.105 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -87.96 171.45 10.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 71.53 110.811 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -137.64 9.99 2.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.218 -0.446 . . . . 74.13 110.878 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -99.24 -62.73 1.2 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 73.43 110.89 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -76.95 61.56 1.97 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 65.02 110.866 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.1 p -99.54 158.94 15.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 74.12 110.835 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 22.8 mm -140.95 139.75 33.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.153 -0.476 . . . . 74.12 111.17 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.7 mtm -145.87 131.82 19.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 73.43 110.902 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 44.0 m-20 -84.06 -169.78 2.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 64.13 110.857 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.19 -58.24 8.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 74.35 110.873 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.1 -55.8 24.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.191 -0.459 . . . . 75.02 110.867 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.47 -58.97 4.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 73.14 110.87 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.3 t -55.42 -38.41 68.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.15 -0.477 . . . . 73.11 110.826 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.09 -45.81 89.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 72.14 110.821 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.3 -58.12 6.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 74.22 111.159 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -54.02 -46.88 71.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 75.51 110.892 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.67 -50.52 66.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.125 -0.489 . . . . 72.25 110.883 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.39 -39.63 57.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.255 -0.43 . . . . 64.21 111.128 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.43 ' HB2' ' HG ' ' A' ' 29' ' ' LEU . 3.4 mt-30 -71.94 -67.56 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.248 -0.433 . . . . 74.14 110.847 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.9 m -46.77 -41.88 5.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 74.13 111.148 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.0 mmmm -65.94 -50.83 62.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.246 -0.433 . . . . 73.22 110.89 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.43 -52.28 39.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 72.22 111.128 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.45 -42.67 87.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 75.13 110.869 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 31.4 mtp85 -50.09 -52.98 30.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.154 -0.475 . . . . 73.13 110.892 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.26 -53.79 32.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 75.13 111.138 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.0 -39.48 26.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.293 -0.412 . . . . 54.3 110.813 -179.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 60.3 t -80.7 -28.13 11.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 72.52 111.088 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 74.43 110.877 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 16.5 m . . . . . 0 C--O 1.23 0.053 0 CA-C-O 120.862 0.363 . . . . 73.32 111.128 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -105.57 159.75 28.43 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.653 0.74 . . . . 64.23 111.162 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 -8.12 22.8 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.699 2.266 . . . . 72.52 112.356 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -97.69 -35.33 10.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 71.53 110.853 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -57.43 -60.02 4.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 71.33 110.874 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -45.74 -68.41 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.18 -0.463 . . . . 74.21 111.124 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -48.2 -39.51 9.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.435 . . . . 75.25 111.166 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -60.18 -47.51 85.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.438 . . . . 75.23 110.875 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.0 t -60.49 -38.82 79.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 74.5 111.168 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.66 -60.05 3.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 72.44 110.939 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.31 -21.22 66.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.475 . . . . 74.11 110.899 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -70.32 -54.2 13.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.267 -0.424 . . . . 71.23 110.918 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.1 mt -91.29 14.84 13.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 75.3 110.931 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 30.5 m 53.89 37.52 26.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.159 -0.473 . . . . 64.43 110.869 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -79.69 83.82 5.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 74.32 110.912 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.19 157.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 70.51 111.137 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -56.45 -23.13 36.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.219 -0.446 . . . . 75.24 110.885 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.63 -48.54 13.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 75.15 110.916 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -61.63 -55.72 27.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.218 -0.447 . . . . 72.55 110.892 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.15 -32.45 10.1 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.184 -0.462 . . . . 73.15 111.087 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 5.6 p -80.54 -35.19 34.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 64.13 110.86 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -73.09 -23.7 60.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.084 -0.507 . . . . 73.53 110.846 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 19.3 mm -105.19 -63.02 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 75.43 111.09 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -74.62 -64.36 1.05 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.228 -0.442 . . . . 75.43 110.911 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 116.78 47.56 0.48 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.706 -0.759 . . . . 63.14 112.459 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -67.42 -35.34 87.01 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.768 -0.73 . . . . 41.52 112.443 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.31 -119.4 5.67 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.756 -0.735 . . . . 74.32 112.541 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.404 HG12 ' H ' ' A' ' 97' ' ' ASN . 0.1 OUTLIER -120.46 -61.57 2.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.859 0.362 . . . . 63.43 111.056 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.404 ' H ' HG12 ' A' ' 96' ' ' VAL . 1.0 OUTLIER -86.15 43.97 1.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.198 -0.455 . . . . 71.14 110.912 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.29 -75.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.144 -0.48 . . . . 74.33 111.125 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -41.81 -39.88 1.89 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 75.24 110.837 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.2 m -59.95 -76.22 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.116 -0.493 . . . . 74.31 110.836 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 -50.34 -44.66 54.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 75.44 110.884 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -55.86 -37.21 68.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 73.52 110.937 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -51.8 -29.26 18.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.1 -0.5 . . . . 74.53 110.867 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -107.16 -22.25 12.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 74.44 110.922 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.39 27.0 9.53 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.664 -0.779 . . . . 73.05 112.462 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 -98.34 -6.64 30.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.842 0.353 . . . . 71.42 110.843 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -110.51 10.57 23.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 43.5 111.123 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.491 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -124.19 57.2 13.02 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.579 0.704 . . . . 71.15 110.91 -179.895 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.496 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.9 Cg_endo -69.74 35.87 0.22 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.635 2.223 . . . . 75.43 112.408 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.762 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER 73.67 32.56 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.634 0.731 . . . . 74.34 110.894 179.934 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.762 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.0 Cg_endo -69.72 -164.02 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.721 2.28 . . . . 74.13 112.351 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.32 -30.95 21.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.473 . . . . 63.14 110.852 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 74.7 m -53.48 -48.08 69.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 73.42 111.101 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 40.2 mm -55.19 -46.27 77.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.45 . . . . 75.11 111.189 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.39 -29.14 70.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.149 -0.478 . . . . 73.22 110.894 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.4 mp -79.69 -42.45 24.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.203 -0.453 . . . . 74.04 110.862 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.425 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 3.8 mt -61.19 -49.71 76.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.451 . . . . 73.2 110.863 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -52.85 -37.22 59.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 72.2 110.859 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 32.8 m -90.87 -11.35 9.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.222 -0.445 . . . . 74.33 111.108 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.425 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.5 OUTLIER -81.71 -40.23 23.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 72.21 110.912 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -50.44 -30.23 12.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 72.41 110.872 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -98.09 -19.26 18.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 74.04 110.876 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 57.1 m-70 -129.64 88.89 48.35 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.607 0.718 . . . . 63.5 110.917 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 2.17 3.77 Favored 'Trans proline' 0 N--CA 1.466 -0.13 0 C-N-CA 122.68 2.253 . . . . 63.34 112.351 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -115.75 -12.59 11.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 74.54 110.872 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.7 tp -54.26 -46.46 72.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 73.41 110.892 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' A' ' 131' ' ' ARG . 0.9 OUTLIER -48.61 -30.62 5.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.165 -0.47 . . . . 64.0 110.896 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . 0.433 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.2 m-80 -85.19 -31.06 23.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 73.41 110.889 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -89.75 4.41 49.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 74.2 110.86 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 12.8 pt -123.63 -34.84 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.477 . . . . 75.14 111.157 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.433 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 73.22 110.873 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.85 0.357 . . . . 71.03 110.895 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.43 -169.71 0.46 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.261 -0.427 . . . . 75.44 110.871 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.417 ' O ' ' N ' ' A' ' 7' ' ' HIS . 1.9 p 176.7 59.42 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.61 0.719 . . . . 74.45 110.937 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.7 1.74 4.13 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.664 2.242 . . . . 74.04 112.371 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.8 m -92.93 -37.35 8.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 73.21 111.148 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -127.0 -33.52 2.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 74.21 110.878 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.417 ' N ' ' O ' ' A' ' 3' ' ' CYS . 15.9 m-70 66.6 57.56 0.68 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.23 -0.441 . . . . 72.33 110.84 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -123.49 -75.78 0.6 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.278 -0.419 . . . . 75.22 110.869 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.56 -116.05 3.02 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.783 -0.722 . . . . 73.12 112.484 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -176.65 94.82 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.768 0.318 . . . . 72.33 110.929 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.567 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.3 ptp -54.62 106.19 0.2 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 75.52 110.809 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.2 p -143.27 124.44 10.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 74.24 111.128 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 p -48.75 132.05 17.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 73.31 110.897 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.409 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.98 81.93 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.763 -0.732 . . . . 74.04 112.516 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.409 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.88 146.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.848 0.356 . . . . 74.44 111.154 -179.933 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.86 -165.51 1.65 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.183 -0.462 . . . . 73.34 110.94 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.19 116.76 29.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 75.12 110.871 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.1 mm -107.52 92.89 9.07 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.687 0.756 . . . . 74.22 111.112 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 97.1 0.63 Allowed 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.651 2.234 . . . . 72.51 112.343 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -62.94 -38.54 91.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 75.53 110.899 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.0 m -128.91 144.53 51.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 63.33 111.167 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -133.89 43.43 2.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.282 -0.417 . . . . 73.4 110.916 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.28 -68.38 0.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.154 -0.476 . . . . 75.55 110.884 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -136.53 -46.04 0.08 OUTLIER Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.674 -0.774 . . . . 64.21 112.47 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.32 39.77 1.09 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.857 0.361 . . . . 74.34 110.885 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -52.32 115.42 1.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 73.32 110.931 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 t -129.06 93.32 3.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.261 -0.427 . . . . 73.42 111.13 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 46.4 t -76.63 127.53 37.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.449 . . . . 73.31 111.117 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.71 51.22 2.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 73.25 110.95 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.2 mttp -37.74 107.64 0.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 75.42 110.88 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.67 47.46 0.4 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.791 -0.718 . . . . 73.35 112.497 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 16.7 mm -107.93 92.12 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.799 0.333 . . . . 74.32 111.2 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.05 154.07 38.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.456 . . . . 61.35 110.868 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.25 -107.8 0.29 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.708 -0.758 . . . . 62.31 112.493 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.567 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 45.1 mt -156.99 87.23 0.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.743 0.306 . . . . 73.12 110.856 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -162.62 159.47 24.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.195 -0.457 . . . . 74.34 110.929 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 36.1 t -168.56 -38.86 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.078 -0.51 . . . . 73.4 110.881 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.5 p -124.05 -47.02 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 75.2 111.146 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -91.1 171.76 9.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 71.53 110.891 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.8 p -137.3 9.58 2.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 74.13 110.831 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -100.38 -62.67 1.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 73.43 110.926 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -76.73 61.68 1.89 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 65.02 110.865 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.4 p -99.08 159.5 14.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 74.12 110.881 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 21.3 mm -143.85 140.06 25.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 74.12 111.121 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.7 mtt -143.27 135.11 26.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.439 . . . . 73.43 110.859 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -86.89 -169.5 2.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.187 -0.46 . . . . 64.13 110.921 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.83 -60.87 2.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.166 -0.47 . . . . 74.35 110.961 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -52.29 -57.07 10.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 75.02 110.843 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -50.84 -58.98 4.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 73.14 110.894 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.8 t -53.89 -40.97 67.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 73.11 110.865 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.93 -44.73 87.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.148 -0.478 . . . . 72.14 110.889 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.72 -60.45 3.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.456 . . . . 74.22 111.034 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -53.56 -47.51 69.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 75.51 110.936 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -48.36 79.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 72.25 110.874 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.45 -42.9 64.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 64.21 111.01 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -69.55 -66.16 0.62 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 74.14 110.968 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.9 m -47.3 -35.94 3.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.241 -0.436 . . . . 74.13 111.083 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 mmmt -69.79 -51.32 34.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.201 -0.454 . . . . 73.22 110.865 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.97 -52.04 53.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.447 . . . . 72.22 111.163 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.41 -46.1 81.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 75.13 110.863 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.93 -52.39 33.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.107 -0.497 . . . . 73.13 110.85 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.87 -54.41 35.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 75.13 111.119 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.06 -41.19 34.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.221 -0.445 . . . . 54.3 110.867 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 41.9 t -78.86 -27.15 13.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.081 -0.509 . . . . 72.52 111.096 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 74.43 110.915 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 19.1 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.793 0.33 . . . . 73.32 111.127 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -104.22 158.18 32.47 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.639 0.733 . . . . 64.23 111.091 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 -7.46 21.09 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.668 2.245 . . . . 72.52 112.377 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -96.43 -39.1 9.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.158 -0.473 . . . . 71.53 110.943 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.424 ' CE1' ' HA ' ' A' ' 118' ' ' ARG . 11.8 t80 -55.31 -60.2 3.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.106 -0.497 . . . . 71.33 110.854 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -45.67 -69.72 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 74.21 111.15 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.1 m -47.76 -38.01 6.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.129 -0.487 . . . . 75.25 111.151 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.1 mtmt -61.47 -45.79 92.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 75.23 110.886 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 69.5 t -61.93 -38.33 80.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 74.5 111.091 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.3 OUTLIER -65.25 -56.61 11.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.28 -0.418 . . . . 72.44 110.822 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.6 pttt -67.17 -21.24 65.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.253 -0.431 . . . . 74.11 110.912 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -71.39 -53.24 14.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 71.23 110.871 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 14.1 mt -91.63 14.99 13.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.238 -0.437 . . . . 75.3 110.943 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.3 m 51.54 38.18 21.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 64.43 110.85 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -79.28 86.75 5.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 74.32 110.827 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.18 155.92 0.18 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 70.51 111.097 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -58.34 -21.65 50.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.173 -0.467 . . . . 75.24 110.91 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -80.68 -53.72 6.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 75.15 110.855 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.08 -47.69 81.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 72.55 110.881 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.5 -32.53 65.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.119 -0.491 . . . . 73.15 111.028 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 26.3 p -80.57 -33.98 35.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.305 -0.407 . . . . 64.13 110.808 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -74.3 -25.7 59.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 73.53 110.881 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 49.7 mt -101.43 -59.76 3.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 75.43 111.132 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -77.99 -62.86 1.54 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 75.43 110.86 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 111.98 50.39 0.59 Allowed Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.77 -0.728 . . . . 63.14 112.538 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -82.12 -44.61 7.49 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.772 -0.728 . . . . 41.52 112.525 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 109.96 167.33 19.82 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.724 -0.75 . . . . 74.32 112.461 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.4 p -56.67 -50.62 73.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.845 0.355 . . . . 63.43 111.124 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -86.18 33.99 0.62 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 71.14 110.934 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.407 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -64.26 -77.17 0.06 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 74.33 111.114 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.407 ' C ' ' O ' ' A' ' 98' ' ' ALA . 47.9 m-85 -37.75 -47.11 0.97 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 75.24 110.854 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.08 -75.39 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.149 -0.478 . . . . 74.31 110.916 -179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 17.2 mtt180 -46.82 -53.64 11.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.093 -0.503 . . . . 75.44 110.865 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -49.6 -39.41 35.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 73.52 110.929 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -51.81 -40.55 60.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.114 -0.494 . . . . 74.53 110.913 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.18 -18.8 22.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.111 -0.495 . . . . 74.44 110.942 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.33 25.88 13.22 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.726 -0.749 . . . . 73.05 112.492 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -92.82 -28.65 16.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.847 0.356 . . . . 71.42 110.926 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -98.13 18.86 15.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 43.5 111.083 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.53 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.9 OUTLIER -121.01 53.87 3.65 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.607 0.718 . . . . 71.15 110.913 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.5 Cg_endo -69.75 27.06 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.652 2.235 . . . . 75.43 112.374 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.731 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.0 m170 70.87 36.02 0.1 Allowed Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 121.649 0.738 . . . . 74.34 110.919 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.731 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.3 Cg_endo -69.74 -165.28 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.608 2.205 . . . . 74.13 112.363 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 12.9 p -82.56 -32.72 28.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 63.14 110.882 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 17.3 m -49.02 -42.73 39.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 73.42 111.068 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 24.4 mm -60.76 -43.5 95.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.253 -0.431 . . . . 75.11 111.13 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -29.67 70.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 73.22 110.929 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 8.1 mp -81.49 -47.61 12.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.236 -0.438 . . . . 74.04 110.9 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.426 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 34.9 mt -56.39 -47.81 78.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.448 . . . . 73.2 110.926 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.424 ' HA ' ' CE1' ' A' ' 73' ' ' PHE . 15.3 ptp180 -55.18 -36.09 65.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 72.2 110.815 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.503 ' HA ' ' CD ' ' A' ' 122' ' ' LYS . 19.9 m -95.91 0.22 10.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.287 -0.415 . . . . 74.33 111.15 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.426 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.5 OUTLIER -92.21 -38.29 12.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.105 -0.498 . . . . 72.21 110.915 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -52.45 -24.4 7.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 72.41 110.844 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.503 ' CD ' ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -100.66 -20.37 15.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.244 -0.434 . . . . 74.04 110.942 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.406 ' HD2' ' CG ' ' A' ' 122' ' ' LYS . 51.0 m-70 -130.19 91.05 40.11 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.547 0.689 . . . . 63.5 110.935 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.69 2.05 3.84 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.658 2.238 . . . . 63.34 112.326 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -116.45 -12.17 11.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.439 . . . . 74.54 110.924 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.8 tp -52.9 -47.4 67.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 73.41 110.955 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.41 ' O ' ' HB3' ' A' ' 131' ' ' ARG . 1.8 pt? -49.7 -29.52 7.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.132 -0.485 . . . . 64.0 110.901 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . 0.474 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.2 m-80 -86.08 -28.41 24.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.46 . . . . 73.41 110.855 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.71 5.36 51.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 74.2 110.936 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . 0.404 HG12 ' HA ' ' A' ' 127' ' ' LEU . 11.4 pt -124.8 -35.18 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 75.14 111.145 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.474 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.6 ptt-85 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 73.22 110.859 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mmt . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.817 0.341 . . . . 71.03 110.852 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.34 -169.14 0.43 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 75.44 110.926 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.0 p -179.83 59.7 0.1 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.611 0.72 . . . . 74.45 110.925 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -4.51 14.18 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.684 2.256 . . . . 74.04 112.332 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 2.1 t -74.43 -62.17 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 73.21 111.14 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.4 t -120.14 -18.58 8.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.861 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 63.65 79.88 0.25 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.252 -0.431 . . . . 72.33 110.848 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -138.52 -75.49 0.38 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 75.22 110.952 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -98.05 -114.27 3.32 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.678 -0.773 . . . . 73.12 112.481 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -170.62 93.94 0.2 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.801 0.334 . . . . 72.33 110.945 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.534 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.7 OUTLIER -54.18 98.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 75.52 110.874 -179.934 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 15.0 p -144.32 131.02 16.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 74.24 111.087 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -44.91 122.75 3.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 73.31 110.831 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.76 81.58 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.713 -0.756 . . . . 74.04 112.509 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -37.89 148.38 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.862 0.363 . . . . 74.44 111.153 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.42 -165.95 1.8 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 73.34 110.939 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.81 116.98 30.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 75.12 110.859 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.9 mm -107.74 91.78 7.91 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.548 0.689 . . . . 74.22 111.096 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 96.29 0.59 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.658 2.239 . . . . 72.51 112.359 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -63.32 -37.6 87.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 75.53 110.956 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 16.4 m -128.78 147.22 50.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.111 -0.495 . . . . 63.33 111.204 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -144.19 37.22 1.25 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 73.4 110.867 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.01 -39.74 1.73 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.193 -0.458 . . . . 75.55 110.897 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -156.76 -58.82 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.67 -0.776 . . . . 64.21 112.441 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.92 46.77 1.35 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.869 0.366 . . . . 74.34 110.888 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -53.74 116.31 2.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 73.32 110.923 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 t -131.58 92.2 3.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.305 -0.407 . . . . 73.42 111.186 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 42.8 t -76.61 127.55 37.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 73.31 111.127 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.79 51.51 2.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 73.25 110.893 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 20.2 mttp -38.99 107.33 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.215 -0.448 . . . . 75.42 110.888 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.67 44.91 0.4 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.75 -0.738 . . . . 73.35 112.496 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 14.3 mm -105.58 90.09 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.885 0.374 . . . . 74.32 111.17 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.77 156.62 37.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 61.35 110.857 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.34 -106.65 0.27 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.784 -0.722 . . . . 62.31 112.507 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.534 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 65.2 mt -155.61 83.95 1.04 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.781 0.324 . . . . 73.12 110.899 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.447 ' CD1' ' N ' ' A' ' 36' ' ' TYR . 0.1 OUTLIER -169.99 149.66 3.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.257 -0.429 . . . . 74.34 110.972 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.2 t -167.47 25.74 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.109 -0.496 . . . . 73.4 110.859 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.9 p 179.29 -34.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 75.2 111.138 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -113.79 176.2 5.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.195 -0.457 . . . . 71.53 110.795 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.58 24.57 1.38 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.485 . . . . 74.13 110.877 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -100.82 -77.42 0.54 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 73.43 110.895 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -78.28 60.75 2.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.475 . . . . 65.02 110.892 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.0 p -87.9 162.77 16.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 74.12 110.892 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 21.1 mm -146.99 139.3 19.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 74.12 111.044 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.2 mtt -142.67 146.02 34.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 73.43 110.869 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.5 m-20 -95.56 -169.09 1.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.158 -0.473 . . . . 64.13 110.88 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -55.12 -60.53 3.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 74.35 110.886 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -52.67 -57.95 8.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.436 . . . . 75.02 110.877 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.53 -59.35 4.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 73.14 110.834 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.6 t -52.82 -42.39 65.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.187 -0.46 . . . . 73.11 110.815 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.25 -44.34 83.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.129 -0.487 . . . . 72.14 110.899 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.89 -61.76 1.97 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 74.22 111.157 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -52.44 -46.87 66.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.25 -0.432 . . . . 75.51 110.855 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.34 -49.57 73.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 72.25 110.889 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.49 -42.12 61.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 64.21 111.035 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -70.32 -66.9 0.54 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.272 -0.422 . . . . 74.14 110.961 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.6 m -46.95 -35.64 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.449 . . . . 74.13 111.109 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.8 mmmm -70.42 -51.95 25.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 73.22 110.912 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.26 -51.49 53.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.277 -0.42 . . . . 72.22 111.143 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.41 -45.81 78.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 75.13 110.935 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.35 -46.86 56.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 73.13 110.863 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.21 -57.52 5.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 75.13 111.078 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.26 -39.2 13.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 54.3 110.85 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.0 t -80.59 -31.28 12.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 72.52 111.126 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 74.43 110.928 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 4.7 m . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.822 0.344 . . . . 73.32 111.095 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -92.83 157.49 39.42 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.509 0.671 . . . . 64.23 111.077 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -6.33 18.35 Favored 'Trans proline' 0 C--N 1.34 0.121 0 C-N-CA 122.669 2.246 . . . . 72.52 112.35 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -92.45 -44.6 8.58 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.23 -0.441 . . . . 71.53 110.834 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -52.9 -62.22 1.79 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 71.33 110.904 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -44.63 -69.97 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.142 -0.481 . . . . 74.21 111.095 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 26.7 m -48.28 -39.17 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.175 -0.466 . . . . 75.25 111.12 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -59.68 -47.21 86.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 75.23 110.898 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 98.7 t -60.29 -39.4 80.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 74.5 111.146 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.06 -60.39 3.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 72.44 110.793 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -63.89 -22.72 67.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.257 -0.429 . . . . 74.11 110.864 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 14.2 ttmm -68.18 -54.71 15.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.462 . . . . 71.23 110.904 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.2 mt -91.6 15.91 11.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.241 -0.436 . . . . 75.3 110.902 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.88 39.53 26.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 64.43 110.811 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -79.34 86.15 5.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.144 -0.48 . . . . 74.32 110.937 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -44.95 156.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.247 -0.433 . . . . 70.51 111.109 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -59.04 -20.6 54.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 75.24 110.951 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -81.35 -53.69 6.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 75.15 110.909 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -59.57 -48.66 80.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.47 . . . . 72.55 110.81 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.12 -32.87 64.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.178 -0.465 . . . . 73.15 111.11 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 28.6 t -79.42 -31.63 42.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 64.13 110.828 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -79.47 -24.24 42.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 73.53 110.894 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 50.7 mt -103.61 -62.07 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.481 . . . . 75.43 111.158 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -75.31 -64.16 1.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.173 -0.467 . . . . 75.43 110.85 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 116.73 49.33 0.43 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.718 -0.753 . . . . 63.14 112.519 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -82.95 -45.39 6.7 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.701 -0.761 . . . . 41.52 112.434 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 109.66 166.89 20.05 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.762 -0.733 . . . . 74.32 112.489 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.7 p -50.91 -51.69 19.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.827 0.346 . . . . 63.43 111.096 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 28.2 m-20 -87.23 40.21 0.91 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 71.14 110.886 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.404 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -63.86 -78.22 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.226 -0.443 . . . . 74.33 111.073 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.404 ' C ' ' O ' ' A' ' 98' ' ' ALA . 40.6 m-85 -38.2 -42.55 0.69 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.165 -0.471 . . . . 75.24 110.932 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.0 t -60.02 -74.81 0.07 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.181 -0.463 . . . . 74.31 110.851 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 34.6 mtt85 -49.64 -46.8 49.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.164 -0.471 . . . . 75.44 110.931 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -56.63 -35.47 68.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.149 -0.478 . . . . 73.52 110.886 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -77.86 -3.77 43.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 74.53 110.894 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.2 -19.1 10.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 74.44 110.927 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.84 19.83 35.79 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.703 -0.761 . . . . 73.05 112.495 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.1 m-20 -98.39 -29.51 13.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.764 0.316 . . . . 71.42 110.826 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -99.16 26.05 6.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 43.5 111.063 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.553 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 0.0 OUTLIER -126.37 47.51 2.44 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.606 0.717 . . . . 71.15 110.937 -179.982 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.553 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.4 Cg_endo -69.7 24.94 0.17 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.669 2.246 . . . . 75.43 112.333 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.736 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 15.2 t-160 69.98 35.15 0.1 OUTLIER Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.586 0.707 . . . . 74.34 110.857 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.736 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.2 Cg_endo -69.82 -165.31 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.711 2.274 . . . . 74.13 112.259 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.5 t -79.84 -29.86 40.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.161 -0.472 . . . . 63.14 110.882 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 39.7 m -52.41 -39.25 60.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.161 -0.472 . . . . 73.42 111.184 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.518 HD11 ' HG2' ' A' ' 108' ' ' GLN . 33.1 mm -63.45 -44.3 98.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.456 . . . . 75.11 111.138 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -29.16 69.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.128 -0.487 . . . . 73.22 110.858 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 8.1 mp -81.94 -44.93 16.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.277 -0.42 . . . . 74.04 110.916 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.437 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 39.8 mt -59.59 -48.27 82.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.456 . . . . 73.2 110.856 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -54.11 -37.61 64.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.228 -0.442 . . . . 72.2 110.928 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 27.4 m -91.88 -8.6 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 74.33 111.095 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.437 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.5 OUTLIER -83.24 -40.06 20.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 72.21 110.917 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -49.72 -31.31 11.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 72.41 110.873 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.93 -19.69 17.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 74.04 110.908 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 34.9 m-70 -127.76 87.03 56.88 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.591 0.71 . . . . 63.5 110.875 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 3.37 2.83 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.703 2.269 . . . . 63.34 112.35 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -116.97 -12.7 10.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 74.54 110.92 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.1 tp -53.97 -46.68 71.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.466 . . . . 73.41 110.941 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.407 ' O ' ' HB3' ' A' ' 131' ' ' ARG . 1.7 pt? -49.65 -29.43 7.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.459 . . . . 64.0 110.912 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . 0.47 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.56 -27.93 23.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 73.41 110.864 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -94.15 4.96 53.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 74.2 110.955 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . 0.4 HG12 ' HA ' ' A' ' 127' ' ' LEU . 11.7 pt -124.24 -35.01 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 75.14 111.139 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.47 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.4 ptt-85 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 73.22 110.922 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.849 0.357 . . . . 71.03 110.949 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.75 -170.39 0.48 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 75.44 110.905 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.412 ' C ' ' H ' ' A' ' 5' ' ' VAL . 1.6 p 178.99 56.96 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.555 0.693 . . . . 74.45 110.904 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 7.28 1.02 Allowed 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.658 2.239 . . . . 74.04 112.381 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.412 ' H ' ' C ' ' A' ' 3' ' ' CYS . 3.5 m -102.27 -43.3 9.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 73.21 111.114 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.9 -31.92 4.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.192 -0.458 . . . . 74.21 110.915 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 63.5 49.06 3.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.148 -0.478 . . . . 72.33 110.859 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 72.6 mm-40 -117.13 -75.6 0.58 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 75.22 110.881 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.401 ' HA3' ' HB3' ' A' ' 39' ' ' HIS . . . -93.76 -117.14 2.71 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.728 -0.749 . . . . 73.12 112.561 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -174.08 93.27 0.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.857 0.36 . . . . 72.33 110.887 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.511 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.2 ptp -52.65 106.1 0.15 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 75.52 110.931 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.5 p -147.41 127.81 5.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.238 -0.437 . . . . 74.24 111.176 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -45.38 127.45 7.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 73.31 110.864 -179.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.95 81.74 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.741 -0.742 . . . . 74.04 112.467 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -37.38 147.34 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.887 0.375 . . . . 74.44 111.12 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.32 -165.77 1.77 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 73.34 110.906 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.38 116.66 29.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 75.12 110.856 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.0 mm -107.62 92.44 8.62 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.644 0.735 . . . . 74.22 111.138 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 96.88 0.61 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.688 2.259 . . . . 72.51 112.345 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -62.65 -38.45 90.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 75.53 110.93 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 16.8 m -129.04 145.38 51.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.071 -0.513 . . . . 63.33 111.125 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -135.48 46.51 2.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 73.4 110.886 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.79 -68.39 0.64 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.163 -0.471 . . . . 75.55 110.908 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -137.21 -42.71 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.718 -0.754 . . . . 64.21 112.463 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.03 39.4 1.23 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.852 0.358 . . . . 74.34 110.865 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.8 tttm -51.64 117.27 2.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.287 -0.415 . . . . 73.32 110.915 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 t -129.66 92.15 3.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.257 -0.429 . . . . 73.42 111.119 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 40.4 t -76.77 127.18 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 73.31 111.189 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.83 51.92 2.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.474 . . . . 73.25 110.885 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.1 mttm -39.14 106.94 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 75.42 110.899 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.91 45.3 0.38 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.795 -0.717 . . . . 73.35 112.498 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 14.4 mm -105.93 91.3 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.834 0.35 . . . . 74.32 111.195 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.85 158.59 33.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.246 -0.434 . . . . 61.35 110.848 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 163.11 -105.99 0.27 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.709 -0.758 . . . . 62.31 112.45 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.511 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 46.9 mt -156.67 83.4 0.96 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.789 0.328 . . . . 73.12 110.952 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' A' ' 36' ' ' TYR . 0.1 OUTLIER -168.96 169.44 9.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.204 -0.453 . . . . 74.34 110.906 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.51 -33.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.061 -0.518 . . . . 73.4 110.909 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 p -120.23 -45.76 2.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 75.2 111.098 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.401 ' HB3' ' HA3' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -99.4 178.44 4.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 71.53 110.821 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 24.1 p -148.88 29.95 0.81 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.206 -0.452 . . . . 74.13 110.887 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -104.52 -77.27 0.58 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.453 . . . . 73.43 110.865 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -77.55 59.95 2.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.504 . . . . 65.02 110.881 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.7 p -83.74 158.88 21.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 74.12 110.832 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 28.1 mm -144.34 140.81 24.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.1 -0.5 . . . . 74.12 111.08 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.9 mtt -144.76 142.38 29.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.136 -0.484 . . . . 73.43 110.834 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.0 m-20 -90.76 -172.96 3.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 64.13 110.894 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.52 -62.1 1.84 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.47 . . . . 74.35 110.932 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -51.05 -58.17 6.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.155 -0.475 . . . . 75.02 110.885 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -49.13 -59.12 3.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 73.14 110.861 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.9 t -53.46 -42.05 66.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 73.11 110.895 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.24 -44.1 83.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.136 -0.484 . . . . 72.14 110.867 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.33 -61.37 2.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 74.22 111.048 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -52.83 -46.66 67.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 75.51 110.873 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.55 -49.61 72.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.49 . . . . 72.25 110.853 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.61 -42.77 62.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.276 -0.42 . . . . 64.21 111.033 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -70.04 -66.79 0.55 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 74.14 110.879 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.7 m -46.68 -35.63 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 74.13 111.134 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -70.56 -51.01 31.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.468 . . . . 73.22 110.857 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.74 -51.18 58.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.302 -0.408 . . . . 72.22 111.038 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -67.34 -45.09 77.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.25 -0.432 . . . . 75.13 110.894 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 -50.63 -50.55 53.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.177 -0.465 . . . . 73.13 110.88 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.24 -56.26 12.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.452 . . . . 75.13 111.156 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -46.67 -42.99 17.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 54.3 110.892 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.3 t -74.09 -34.33 38.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 72.52 111.146 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.43 110.882 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 15.7 m . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.856 0.36 . . . . 73.32 111.145 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -102.99 154.14 37.77 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.601 0.715 . . . . 64.23 111.118 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 -7.67 21.65 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.721 2.281 . . . . 72.52 112.31 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -95.98 -38.92 10.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 71.53 110.88 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.419 ' CE1' ' HA ' ' A' ' 118' ' ' ARG . 12.3 t80 -56.23 -59.98 4.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.49 . . . . 71.33 110.9 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -45.22 -68.79 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.104 -0.498 . . . . 74.21 111.16 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.6 m -48.75 -39.1 10.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 75.25 111.144 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -61.04 -38.19 85.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 75.23 110.875 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.2 t -70.88 -37.15 67.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.247 -0.433 . . . . 74.5 111.163 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.81 -33.16 70.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 72.44 110.857 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.37 -20.1 24.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.195 -0.457 . . . . 74.11 110.936 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.2 ttmm -76.19 -51.5 11.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 71.23 110.956 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.3 mt -89.89 13.56 14.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.237 -0.438 . . . . 75.3 110.914 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.24 42.16 28.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 64.43 110.953 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -78.73 85.03 4.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.041 -0.527 . . . . 74.32 110.904 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.22 156.66 0.15 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.124 -0.489 . . . . 70.51 111.086 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -57.64 -23.01 48.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 75.24 110.911 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.0 mttm -79.47 -53.29 7.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 75.15 110.904 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -63.66 -53.72 47.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 72.55 110.905 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.65 -36.31 61.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.087 -0.506 . . . . 73.15 111.147 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.7 t -79.01 -28.81 43.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 64.13 110.824 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -78.08 -29.56 49.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.108 -0.496 . . . . 73.53 110.885 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 18.3 mm -98.8 -58.24 3.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.096 -0.502 . . . . 75.43 111.18 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -77.11 -64.36 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 75.43 110.842 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 110.54 45.37 0.91 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.786 -0.721 . . . . 63.14 112.479 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.71 -45.04 93.95 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.67 -0.776 . . . . 41.52 112.513 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.04 172.23 21.75 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.72 -0.752 . . . . 74.32 112.464 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -50.53 -66.52 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.873 0.368 . . . . 63.43 111.161 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -86.21 42.4 0.99 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.471 . . . . 71.14 110.945 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.41 -76.17 0.06 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.124 -0.489 . . . . 74.33 111.084 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -39.69 -39.49 0.77 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.433 . . . . 75.24 110.866 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.9 m -61.01 -76.31 0.05 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 74.31 110.89 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 29.0 mtt85 -50.04 -45.61 52.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 75.44 110.855 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -57.6 -37.22 72.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 73.52 110.941 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -62.75 -16.92 59.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 74.53 110.86 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.94 -20.54 12.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.238 -0.437 . . . . 74.44 110.926 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.8 28.75 11.65 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.724 -0.75 . . . . 73.05 112.458 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -106.71 -8.55 16.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.846 0.355 . . . . 71.42 110.905 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -115.06 13.65 16.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 43.5 111.088 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.478 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -126.48 55.72 14.75 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.618 0.723 . . . . 71.15 110.863 -179.899 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.477 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.5 Cg_endo -69.78 36.54 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.661 2.241 . . . . 75.43 112.358 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.753 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 1.0 OUTLIER 72.05 33.92 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.551 0.691 . . . . 74.34 110.828 179.917 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . 0.753 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.2 Cg_endo -69.7 -164.14 0.12 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.722 2.281 . . . . 74.13 112.364 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.35 -32.81 32.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 63.14 110.861 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 22.7 m -52.7 -54.09 38.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.158 -0.474 . . . . 73.42 111.18 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 46.4 mm -50.95 -45.24 28.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 75.11 111.165 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -29.51 70.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 73.22 110.89 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.3 mp -80.01 -49.86 11.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.199 -0.455 . . . . 74.04 110.917 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.441 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 20.6 mt -55.42 -47.97 75.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 73.2 110.91 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.419 ' HA ' ' CE1' ' A' ' 73' ' ' PHE . 17.3 ptp180 -55.18 -35.54 64.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 72.2 110.908 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.473 ' HA ' ' HD3' ' A' ' 122' ' ' LYS . 18.8 m -96.95 0.32 10.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 74.33 111.132 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.441 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.7 OUTLIER -93.1 -36.52 12.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 72.21 110.878 179.95 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -53.03 -24.37 9.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.12 -0.491 . . . . 72.41 110.882 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.473 ' HD3' ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -99.7 -20.2 16.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 74.04 110.935 179.982 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -132.52 93.4 25.02 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.604 0.716 . . . . 63.5 110.934 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 -0.02 6.32 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.7 2.267 . . . . 63.34 112.333 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -114.31 -11.34 12.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.259 -0.428 . . . . 74.54 110.902 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 7.8 tp -53.27 -49.15 67.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.122 -0.49 . . . . 73.41 110.861 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.425 ' HA ' HG12 ' A' ' 130' ' ' ILE . 2.0 pt? -51.28 -28.86 13.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.276 -0.42 . . . . 64.0 110.863 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . 0.466 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.36 -27.11 24.46 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.216 -0.447 . . . . 73.41 110.844 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -94.12 2.46 55.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.269 -0.423 . . . . 74.2 110.899 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . 0.425 HG12 ' HA ' ' A' ' 127' ' ' LEU . 13.3 pt -121.47 -34.26 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 75.14 111.176 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.466 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 2.5 ptt-85 . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.104 -0.498 . . . . 73.22 110.826 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mtt . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.867 0.365 . . . . 71.03 110.88 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.34 -170.58 0.53 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 75.44 110.846 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.435 ' O ' ' N ' ' A' ' 7' ' ' HIS . 0.1 OUTLIER 174.27 59.1 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.596 0.713 . . . . 74.45 110.847 179.922 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -2.64 10.54 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.689 2.259 . . . . 74.04 112.328 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.5 m -84.08 -43.14 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.255 -0.429 . . . . 73.21 111.106 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.77 -28.62 3.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 74.21 110.888 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.435 ' N ' ' O ' ' A' ' 3' ' ' CYS . 21.3 m-70 67.66 46.31 1.35 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 72.33 110.878 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -107.6 -74.05 0.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.434 . . . . 75.22 110.872 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.81 -134.72 8.55 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.719 -0.753 . . . . 73.12 112.483 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -155.19 88.26 1.16 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 72.33 110.863 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.521 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -48.97 105.5 0.08 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 75.52 110.895 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.9 p -142.01 126.65 16.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 74.24 111.145 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.4 p -49.09 130.98 19.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 73.31 110.865 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.411 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 178.94 80.76 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.748 -0.739 . . . . 74.04 112.464 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.411 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -37.12 146.83 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.93 0.395 . . . . 74.44 111.108 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.8 -165.51 1.66 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.124 -0.489 . . . . 73.34 110.893 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.59 116.97 29.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.235 -0.439 . . . . 75.12 110.907 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.2 mm -107.59 91.96 7.93 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.652 0.739 . . . . 74.22 111.142 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 96.89 0.61 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.654 2.236 . . . . 72.51 112.344 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -64.5 -36.92 85.74 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 75.53 110.919 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 16.7 m -128.87 146.79 50.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 63.33 111.139 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.8 p90 -143.87 36.18 1.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 73.4 110.882 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.55 -40.23 2.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 75.55 110.854 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -157.42 -57.92 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.713 -0.756 . . . . 64.21 112.478 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.18 46.31 1.3 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.876 0.37 . . . . 74.34 110.882 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -53.09 116.48 2.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 73.32 110.887 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 t -130.74 92.55 3.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 73.42 111.123 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 44.5 t -77.07 127.55 38.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 73.31 111.073 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.4 ' O ' ' C ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -85.05 51.43 2.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 73.25 110.893 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 29' ' ' LEU . 19.0 mttm -38.08 107.69 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 75.42 110.933 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 119.45 46.58 0.4 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.764 -0.732 . . . . 73.35 112.534 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 15.1 mm -107.73 91.69 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.884 0.373 . . . . 74.32 111.117 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.27 154.61 38.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 61.35 110.883 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 168.32 -109.33 0.33 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.761 -0.733 . . . . 62.31 112.502 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.521 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 53.8 mt -156.98 87.0 0.98 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.856 0.36 . . . . 73.12 110.897 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -159.73 160.18 33.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 74.34 110.921 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.7 t -171.82 -40.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.137 -0.483 . . . . 73.4 110.905 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 p -120.9 -46.54 2.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 75.2 111.139 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -92.1 170.65 9.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.494 . . . . 71.53 110.807 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.47 21.12 2.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.196 -0.456 . . . . 74.13 110.877 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -112.0 -61.79 1.66 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 73.43 110.863 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -77.34 61.67 2.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 65.02 110.874 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.0 p -95.24 154.28 17.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 74.12 110.859 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 19.0 mm -140.89 139.84 33.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 74.12 111.136 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.6 mtt -142.15 143.84 33.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 73.43 110.909 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.1 m-20 -92.51 -169.67 2.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.236 -0.438 . . . . 64.13 110.893 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -60.92 2.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 74.35 110.902 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.91 -57.58 8.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.262 -0.427 . . . . 75.02 110.857 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.72 -58.01 6.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 73.14 110.865 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.8 t -53.65 -42.64 68.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 73.11 110.809 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.2 -44.14 83.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.164 -0.471 . . . . 72.14 110.856 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.14 -62.08 1.75 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 74.22 111.093 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -52.05 -46.21 65.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 75.51 110.834 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.94 -51.33 64.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 72.25 110.905 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -50.51 -40.24 50.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.444 . . . . 64.21 111.099 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -72.07 -67.85 0.51 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 74.14 110.902 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.2 m -46.47 -36.87 3.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.448 . . . . 74.13 111.135 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.62 -50.73 33.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 73.22 110.908 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.11 -50.99 60.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 72.22 111.066 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.53 -46.16 77.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 75.13 110.874 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.48 -51.51 35.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.133 -0.485 . . . . 73.13 110.872 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.37 -54.68 25.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 75.13 111.095 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.08 -40.53 32.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.243 -0.435 . . . . 54.3 110.86 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 42.4 t -79.68 -27.4 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.132 -0.485 . . . . 72.52 111.15 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.93 -19.41 60.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 74.43 110.905 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.74 -22.07 63.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 75.05 111.099 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -60.09 -175.27 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 75.41 110.931 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 86.4 m -57.36 -77.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.172 -0.467 . . . . 74.54 111.125 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 4.6 m -139.35 -175.7 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 73.32 111.1 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -106.02 159.41 29.74 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.587 0.708 . . . . 64.23 111.079 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 -7.54 21.34 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.682 2.255 . . . . 72.52 112.292 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -92.19 -39.5 11.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 71.53 110.876 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -57.34 -61.17 2.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 71.33 110.88 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -44.74 -68.11 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 74.21 111.136 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.1 m -48.85 -39.09 11.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 75.25 111.144 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.6 mtmt -60.4 -39.41 87.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 75.23 110.9 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 99.6 t -70.35 -37.97 72.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 74.5 111.167 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.66 -33.33 72.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 72.44 110.859 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.1 pttt -89.53 -19.25 25.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 74.11 110.886 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 21.8 ttmt -75.97 -51.19 12.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 71.23 110.87 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.3 mt -92.09 14.66 15.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.205 -0.452 . . . . 75.3 110.915 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.32 41.13 27.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 64.43 110.881 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -79.04 86.46 4.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.138 -0.483 . . . . 74.32 110.872 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -45.83 156.05 0.15 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 70.51 111.157 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.23 -19.41 54.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 75.24 110.883 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -53.21 6.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 75.15 110.917 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -62.63 -49.34 75.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.234 -0.439 . . . . 72.55 110.946 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.57 -31.64 62.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 73.15 111.153 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 24.5 p -80.02 -35.79 36.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 64.13 110.885 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -74.81 -22.82 58.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.09 -0.504 . . . . 73.53 110.904 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 52.8 mt -103.71 -62.87 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 75.43 111.142 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -75.64 -63.95 1.18 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 75.43 110.902 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 124.69 34.36 0.7 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.731 -0.747 . . . . 63.14 112.475 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -52.01 -50.14 46.2 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.743 -0.741 . . . . 41.52 112.51 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.95 -137.11 13.88 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.739 -0.743 . . . . 74.32 112.526 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.14 -73.36 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.781 0.324 . . . . 63.43 111.147 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -85.25 40.94 0.85 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 71.14 110.89 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -60.35 -75.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 74.33 111.053 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.417 ' C ' ' O ' ' A' ' 98' ' ' ALA . 25.4 m-85 -36.38 -47.03 0.58 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 75.24 110.849 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.1 m -57.38 -76.08 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.481 . . . . 74.31 110.899 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -47.39 -52.8 15.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.08 -0.509 . . . . 75.44 110.859 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -49.67 -38.26 31.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 73.52 110.923 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -54.33 -38.85 66.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.13 -0.486 . . . . 74.53 110.894 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.22 -17.32 22.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.139 -0.482 . . . . 74.44 110.916 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.28 26.19 16.7 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.751 -0.738 . . . . 73.05 112.47 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 74.7 m-80 -94.3 -24.65 17.34 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.863 0.363 . . . . 71.42 110.925 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -105.05 18.7 21.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 43.5 111.085 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.529 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.6 tm0? -120.39 55.98 4.39 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.637 0.732 . . . . 71.15 110.941 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.4 Cg_endo -69.77 28.67 0.18 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.664 2.243 . . . . 75.43 112.334 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.694 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.9 OUTLIER 69.42 38.37 0.17 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.547 0.689 . . . . 74.34 110.842 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.694 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.5 Cg_endo -69.7 -165.49 0.15 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.689 2.259 . . . . 74.13 112.369 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 14.1 m -81.46 -34.41 31.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 63.14 110.845 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 14.8 m -48.78 -42.34 35.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 73.42 111.192 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 27.7 mm -60.26 -44.0 94.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 75.11 111.133 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -29.34 70.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.169 -0.469 . . . . 73.22 110.864 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.6 mp -81.24 -42.83 20.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.244 -0.435 . . . . 74.04 110.881 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.419 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 36.1 mt -61.09 -49.45 77.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 73.2 110.925 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 15.7 ptp180 -51.92 -39.76 59.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 72.2 110.914 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 33.8 m -88.13 -13.01 10.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 74.33 111.092 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.419 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.4 OUTLIER -79.06 -41.35 29.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 72.21 110.874 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -48.79 -32.82 9.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 72.41 110.876 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.2 -21.39 17.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 74.04 110.941 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 42.1 m-70 -126.52 87.66 55.94 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.552 0.691 . . . . 63.5 110.863 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.71 3.37 2.78 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.692 2.261 . . . . 63.34 112.392 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -117.22 -12.45 10.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.177 -0.465 . . . . 74.54 110.898 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.06 -46.57 72.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.168 -0.469 . . . . 73.41 110.932 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.403 ' O ' ' HB3' ' A' ' 131' ' ' ARG . 1.7 pt? -49.73 -29.42 7.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 64.0 110.891 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.472 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.59 -27.55 23.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 73.41 110.885 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -94.68 5.03 53.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 74.2 110.859 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.402 HG12 ' HA ' ' A' ' 127' ' ' LEU . 11.6 pt -124.29 -35.12 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.471 . . . . 75.14 111.117 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.472 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.2 ptt-85 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.178 -0.465 . . . . 73.22 110.893 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.895 0.379 . . . . 71.03 110.917 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.83 -169.04 0.39 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 75.44 110.893 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.8 p 176.73 59.86 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.382 0 CA-C-O 121.576 0.703 . . . . 74.45 110.883 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.84 4.8 2.02 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.646 2.231 . . . . 74.04 112.297 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.2 m -104.01 -45.79 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.436 . . . . 73.21 111.141 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.4 m -107.77 -34.15 7.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 74.21 110.885 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 61.03 46.45 8.3 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.089 -0.505 . . . . 72.33 110.896 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -109.35 -74.21 0.66 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.166 -0.47 . . . . 75.22 110.943 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -107.95 -106.9 3.12 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.695 -0.764 . . . . 73.12 112.535 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -176.56 96.37 0.05 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.89 0.376 . . . . 72.33 110.889 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.566 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.8 ptp -52.58 104.76 0.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.168 -0.469 . . . . 75.52 110.92 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.2 p -143.02 126.1 13.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.254 -0.43 . . . . 74.24 111.151 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -49.77 128.37 17.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.124 -0.489 . . . . 73.31 110.861 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.416 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.26 84.28 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.778 -0.725 . . . . 74.04 112.532 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.416 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.67 145.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.872 0.368 . . . . 74.44 111.146 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.53 -167.28 2.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 73.34 110.856 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.44 118.15 30.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 75.12 110.86 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.3 mm -109.28 91.17 9.28 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.667 0.746 . . . . 74.22 111.161 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.67 95.81 0.56 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.745 2.297 . . . . 72.51 112.404 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -63.43 -37.27 86.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 75.53 110.901 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.408 ' HB ' ' HA ' ' A' ' 26' ' ' LYS . 19.2 m -131.21 149.67 52.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.091 -0.504 . . . . 63.33 111.205 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -148.51 44.22 1.02 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.27 -0.423 . . . . 73.4 110.926 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.29 -46.14 0.77 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.117 -0.492 . . . . 75.55 110.84 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -149.08 -50.46 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.67 -0.776 . . . . 64.21 112.469 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.7 47.1 0.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.912 0.387 . . . . 74.34 110.876 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.408 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 14.8 tttt -55.33 121.62 9.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 73.32 110.9 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.8 t -138.52 93.83 2.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 73.42 111.134 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 44.2 t -77.55 128.14 38.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 73.31 111.104 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.414 ' O ' ' C ' ' A' ' 30' ' ' LYS . 0.2 OUTLIER -84.51 51.92 2.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 73.25 110.955 179.906 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 29' ' ' LEU . 29.0 mttp -37.4 107.7 0.07 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 75.42 110.859 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.27 50.05 0.39 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.713 -0.756 . . . . 73.35 112.478 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 19.0 mm -109.36 93.04 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.787 0.327 . . . . 74.32 111.166 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.27 150.7 38.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 61.35 110.822 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.9 -106.12 0.25 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.805 -0.712 . . . . 62.31 112.501 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.566 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 43.5 mt -156.65 84.82 0.97 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.875 0.369 . . . . 73.12 110.873 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.465 ' CD1' ' N ' ' A' ' 36' ' ' TYR . 0.0 OUTLIER -158.74 162.51 37.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 74.34 110.916 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.2 t -171.28 -37.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.094 -0.503 . . . . 73.4 110.904 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -128.13 -40.56 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 75.2 111.141 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -97.05 170.89 8.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.129 -0.487 . . . . 71.53 110.835 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.25 12.96 2.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.216 -0.447 . . . . 74.13 110.866 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -103.07 -65.2 1.01 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 73.43 110.872 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -76.98 61.46 1.97 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.193 -0.458 . . . . 65.02 110.886 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.5 m -102.06 160.6 14.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 74.12 110.814 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 15.3 mm -141.14 140.79 31.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.118 -0.492 . . . . 74.12 111.135 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 16.2 mtm -143.8 132.45 22.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.087 -0.506 . . . . 73.43 110.889 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 35.8 m-20 -82.65 -169.72 2.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 64.13 110.871 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -61.44 2.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 74.35 110.87 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -51.63 -57.47 9.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.406 . . . . 75.02 110.872 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -50.54 -57.08 8.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 73.14 110.94 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.0 t -55.08 -40.06 69.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.495 . . . . 73.11 110.871 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.44 -45.62 88.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.129 -0.487 . . . . 72.14 110.877 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.22 -59.98 3.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 74.22 111.096 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -53.32 -48.51 68.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.267 -0.424 . . . . 75.51 110.832 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.28 -48.48 79.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 72.25 110.886 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.2 -41.51 62.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 64.21 111.137 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -70.28 -66.67 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 74.14 110.854 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.0 m -47.5 -35.79 4.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.275 -0.42 . . . . 74.13 111.148 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -69.43 -54.48 14.17 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.188 -0.46 . . . . 73.22 110.858 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.16 -52.25 27.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 72.22 111.116 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.32 -48.61 77.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.204 -0.453 . . . . 75.13 110.88 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.8 -36.49 37.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 73.13 110.856 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.58 -53.75 9.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.462 . . . . 75.13 111.116 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.34 -25.73 64.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 54.3 110.84 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 16.3 m -97.48 -16.24 7.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.467 . . . . 72.52 111.092 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.79 -22.95 27.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.23 -0.441 . . . . 74.43 110.899 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -50.81 -30.22 13.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 75.05 111.143 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -113.15 139.65 48.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.278 -0.419 . . . . 75.41 110.883 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 97.3 m -66.04 -75.39 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.145 -0.479 . . . . 74.54 111.155 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 10.8 m -131.95 -172.22 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.252 -0.431 . . . . 73.32 111.169 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -105.24 159.44 29.4 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.559 0.695 . . . . 64.23 111.105 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 -7.37 20.9 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.686 2.258 . . . . 72.52 112.369 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -92.26 -38.72 11.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.434 . . . . 71.53 110.832 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -57.58 -61.36 2.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 71.33 110.898 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -45.15 -67.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 74.21 111.183 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.8 m -48.88 -39.33 11.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 75.25 111.098 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 23.1 mtmt -61.14 -45.04 96.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 75.23 110.864 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 75.8 t -61.81 -39.05 82.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.234 -0.439 . . . . 74.5 111.118 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.37 -58.71 5.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 72.44 110.924 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -24.91 67.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 74.11 110.937 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 18.5 ttmt -68.23 -52.02 38.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.184 -0.462 . . . . 71.23 110.898 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.5 mt -91.82 12.53 21.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 75.3 110.898 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.1 t 53.74 37.48 26.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 64.43 110.898 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -79.69 87.31 5.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 74.32 110.922 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.73 156.38 0.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 70.51 111.129 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.14 -21.15 58.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 75.24 110.899 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -50.13 10.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.254 -0.43 . . . . 75.15 110.873 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.95 -53.0 53.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 72.55 110.84 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -52.19 -33.66 41.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.135 -0.484 . . . . 73.15 111.072 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 23.1 t -79.56 -36.61 38.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 64.13 110.837 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -72.95 -24.38 60.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.112 -0.495 . . . . 73.53 110.939 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 51.4 mt -101.81 -63.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 75.43 111.095 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -74.34 -60.68 2.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 75.43 110.826 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 110.26 49.37 0.72 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.701 -0.762 . . . . 63.14 112.438 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.88 -36.91 31.03 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.764 -0.731 . . . . 41.52 112.501 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 102.82 165.08 26.03 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.771 -0.728 . . . . 74.32 112.522 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.8 p -50.93 -50.89 22.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.89 0.376 . . . . 63.43 111.12 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.87 38.46 0.8 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.487 . . . . 71.14 110.89 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.85 -76.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 74.33 111.097 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -43.02 -40.37 3.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 75.24 110.877 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.1 m -59.98 -75.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.145 -0.479 . . . . 74.31 110.857 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 32.5 mtt180 -50.03 -45.72 52.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.094 -0.503 . . . . 75.44 110.873 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -55.41 -37.31 67.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.24 -0.436 . . . . 73.52 110.852 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -51.3 -30.11 17.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 74.53 110.928 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -106.96 -22.11 12.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.478 . . . . 74.44 110.889 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.69 26.75 9.57 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.784 -0.722 . . . . 73.05 112.539 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -98.06 -4.7 35.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.822 0.344 . . . . 71.42 110.83 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -112.11 8.7 20.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 43.5 111.041 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.492 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -124.73 57.44 15.09 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.563 0.697 . . . . 71.15 110.855 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.506 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.9 Cg_endo -69.78 36.32 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.646 2.231 . . . . 75.43 112.342 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.772 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.5 t-160 73.93 32.28 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.522 0.677 . . . . 74.34 110.846 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.772 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 52.8 Cg_endo -69.86 -163.84 0.12 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.638 2.225 . . . . 74.13 112.316 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.44 -30.26 23.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.251 -0.432 . . . . 63.14 110.845 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 21.1 m -53.34 -50.57 64.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.138 -0.483 . . . . 73.42 111.141 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 41.0 mm -51.31 -42.36 26.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 75.11 111.136 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.17 -29.63 68.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.166 -0.47 . . . . 73.22 110.914 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.7 mp -79.25 -42.1 26.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 74.04 110.941 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.462 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 17.0 mt -63.93 -48.93 74.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 73.2 110.909 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 15.9 ptp180 -52.2 -34.81 47.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 72.2 110.882 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 30.9 m -93.88 -13.91 8.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.475 . . . . 74.33 111.144 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.462 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.4 OUTLIER -77.14 -40.29 46.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 72.21 110.9 179.954 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -50.0 -31.23 12.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.187 -0.461 . . . . 72.41 110.822 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.35 -20.86 18.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 74.04 110.868 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 53.7 m-70 -128.55 88.59 51.87 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.565 0.698 . . . . 63.5 110.835 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 3.4 2.76 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.646 2.231 . . . . 63.34 112.367 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -117.83 -11.98 10.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.43 . . . . 74.54 110.912 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.5 tp -53.54 -47.99 69.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.199 -0.455 . . . . 73.41 110.976 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -46.32 -32.77 3.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.467 . . . . 64.0 110.871 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -81.87 -38.1 25.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.17 -0.468 . . . . 73.41 110.907 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.74 -6.18 55.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.458 . . . . 74.2 110.89 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 7.9 pt -119.17 -20.41 4.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 75.14 111.119 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 73.22 110.892 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mtt . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.885 0.374 . . . . 71.03 110.88 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.02 -169.43 0.4 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 75.44 110.947 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.7 t -178.91 60.12 0.12 Allowed Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.588 0.709 . . . . 74.45 110.876 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -0.1 6.46 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 122.715 2.277 . . . . 74.04 112.324 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.8 m -87.52 -43.96 15.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.268 -0.424 . . . . 73.21 111.153 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.419 ' O ' ' HB2' ' A' ' 7' ' ' HIS . 0.0 OUTLIER -127.17 -30.8 2.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.474 . . . . 74.21 110.913 179.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.419 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 22.1 m-70 69.79 68.91 0.23 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 72.33 110.897 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -132.52 -71.72 0.53 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 75.22 110.994 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.34 -129.99 6.84 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.71 -0.757 . . . . 73.12 112.482 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -161.2 87.89 0.73 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.799 0.333 . . . . 72.33 110.88 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.53 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -50.64 105.04 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.146 -0.479 . . . . 75.52 110.874 179.951 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.0 p -142.58 126.93 15.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 74.24 111.132 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.51 129.28 18.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 73.31 110.791 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.406 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 179.98 81.46 0.06 OUTLIER Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.72 -0.753 . . . . 74.04 112.46 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.406 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -37.02 146.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.912 0.386 . . . . 74.44 111.088 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.91 -165.4 1.62 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.12 -0.491 . . . . 73.34 110.854 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.48 117.15 29.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 75.12 110.792 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.0 mm -107.88 91.53 7.77 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.623 0.725 . . . . 74.22 111.203 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 96.48 0.59 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.678 2.252 . . . . 72.51 112.343 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -61.15 -40.04 92.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 75.53 110.944 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.7 m -126.72 145.18 50.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.126 -0.488 . . . . 63.33 111.17 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -134.02 45.54 2.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 73.4 110.857 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.09 -68.4 0.63 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 75.55 110.911 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -136.08 -46.35 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.704 -0.76 . . . . 64.21 112.475 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.38 39.84 1.09 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.912 0.387 . . . . 74.34 110.918 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -52.67 115.23 1.7 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.079 -0.51 . . . . 73.32 110.907 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 t -127.76 93.81 3.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 73.42 111.118 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 43.7 t -77.69 126.42 38.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 73.31 111.133 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.402 ' O ' ' C ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -84.61 51.42 2.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 73.25 110.923 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.402 ' C ' ' O ' ' A' ' 29' ' ' LEU . 23.1 mttp -38.06 108.03 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 75.42 110.866 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.86 46.66 0.42 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.681 -0.771 . . . . 73.35 112.46 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 14.9 mm -107.61 91.22 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.838 0.352 . . . . 74.32 111.104 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.01 154.29 39.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.209 -0.451 . . . . 61.35 110.827 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.99 -108.57 0.31 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.709 -0.757 . . . . 62.31 112.491 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.53 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 49.9 mt -157.11 86.12 0.96 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.847 0.356 . . . . 73.12 110.874 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -160.02 161.08 33.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.151 -0.477 . . . . 74.34 110.905 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.6 t -169.58 -38.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.109 -0.496 . . . . 73.4 110.853 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.6 m -125.79 -47.18 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 75.2 111.153 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.88 170.43 10.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 71.53 110.892 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.9 t -137.4 15.91 2.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 74.13 110.863 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -104.82 -62.99 1.26 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 73.43 110.876 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -77.15 61.93 2.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 65.02 110.897 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.6 p -97.09 154.21 17.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.088 -0.505 . . . . 74.12 110.891 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 20.1 mm -141.25 139.77 32.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 74.12 111.158 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.8 mtt -142.88 139.68 30.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.425 . . . . 73.43 110.852 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 41.1 m-20 -87.59 -169.94 2.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 64.13 110.885 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -61.03 2.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.191 -0.459 . . . . 74.35 110.843 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.48 -57.44 9.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 75.02 110.979 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.02 -58.15 6.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.031 -0.531 . . . . 73.14 110.84 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.5 t -53.49 -42.38 67.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 73.11 110.926 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.59 -44.0 85.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.093 -0.503 . . . . 72.14 110.936 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.77 -61.82 1.95 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 74.22 111.106 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -52.6 -46.7 67.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.455 . . . . 75.51 110.859 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.41 -49.03 75.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.499 . . . . 72.25 110.91 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.94 -42.66 63.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.474 . . . . 64.21 111.135 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -69.65 -66.54 0.57 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 74.14 110.884 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.3 m -47.24 -35.72 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 74.13 111.143 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.7 mmmt -69.07 -54.89 12.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 73.22 110.883 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.07 -53.58 19.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.246 -0.434 . . . . 72.22 111.063 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.88 -49.27 75.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.45 . . . . 75.13 110.868 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.74 -36.31 25.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 73.13 110.823 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.65 -54.04 9.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.265 -0.425 . . . . 75.13 111.158 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.21 -28.27 64.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 54.3 110.884 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 23.2 m -94.9 -17.29 7.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.095 -0.502 . . . . 72.52 111.166 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.67 -30.3 55.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 74.43 110.862 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.75 -18.9 57.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 75.05 111.106 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -67.07 -18.42 65.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.45 . . . . 75.41 110.893 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 62.2 m -49.1 -69.23 0.12 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 74.54 111.089 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 7.1 m -138.48 -173.12 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 73.32 111.144 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -106.8 159.95 28.06 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.617 0.722 . . . . 64.23 111.104 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.86 -7.48 21.2 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.658 2.239 . . . . 72.52 112.312 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -93.92 -37.44 11.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 71.53 110.856 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -57.76 -61.58 2.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.188 -0.46 . . . . 71.33 110.896 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -44.92 -67.33 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.154 -0.476 . . . . 74.21 111.106 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -48.88 -39.49 11.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 75.25 111.09 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 22.5 mtmt -60.6 -46.17 91.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.459 . . . . 75.23 110.873 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 73.4 t -60.92 -39.3 81.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 74.5 111.094 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.91 -60.73 2.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.181 -0.463 . . . . 72.44 110.848 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -22.91 66.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 74.11 110.832 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -68.94 -54.04 17.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 71.23 110.884 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.2 mt -91.52 14.69 14.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.24 -0.436 . . . . 75.3 110.909 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 11.0 m 53.19 39.47 29.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 64.43 110.838 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.69 88.17 5.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 74.32 110.958 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -46.73 156.87 0.17 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 70.51 111.197 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -59.67 -19.79 51.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 75.24 110.916 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 33.2 mmtt -82.45 -52.45 6.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.194 -0.457 . . . . 75.15 110.873 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -61.75 -51.78 66.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 72.55 110.844 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.44 -34.2 56.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 73.15 111.101 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.4 t -80.14 -31.1 39.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.245 -0.434 . . . . 64.13 110.906 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -77.84 -25.64 48.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.097 -0.502 . . . . 73.53 110.838 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 47.7 mt -101.23 -59.73 3.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 75.43 111.121 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -77.3 -61.12 2.09 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 75.43 110.898 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.78 50.07 0.71 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.767 -0.73 . . . . 63.14 112.486 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -78.77 -38.62 23.25 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 41.52 112.474 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 104.79 166.41 24.28 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.738 -0.744 . . . . 74.32 112.471 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.9 p -51.76 -50.66 31.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.892 0.377 . . . . 63.43 111.101 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -86.91 38.65 0.81 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 71.14 110.917 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.19 -76.46 0.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 74.33 111.08 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -43.33 -40.45 3.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.218 -0.446 . . . . 75.24 110.891 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.8 m -60.09 -75.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 74.31 110.874 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 30.9 mtt180 -49.84 -45.82 50.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 75.44 110.918 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -55.65 -37.28 68.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.197 -0.456 . . . . 73.52 110.904 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -51.83 -29.69 20.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.493 . . . . 74.53 110.856 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.8 -22.29 12.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 74.44 110.94 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.65 26.9 9.45 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.782 -0.723 . . . . 73.05 112.504 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -98.19 -5.85 32.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.857 0.361 . . . . 71.42 110.889 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -110.83 9.22 22.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.136 -0.484 . . . . 43.5 111.07 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.493 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -125.07 57.35 15.83 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.604 0.716 . . . . 71.15 110.835 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.508 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.0 Cg_endo -69.8 36.08 0.23 Allowed 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.656 2.238 . . . . 75.43 112.394 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.777 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 1.7 t-80 74.1 31.99 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.547 0.689 . . . . 74.34 110.849 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.777 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.6 Cg_endo -69.74 -163.83 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.71 2.273 . . . . 74.13 112.324 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 20.2 m -85.67 -29.58 23.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.445 . . . . 63.14 110.884 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 22.0 m -53.7 -50.84 65.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.113 -0.494 . . . . 73.42 111.14 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 39.3 mm -51.06 -42.61 24.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.249 -0.432 . . . . 75.11 111.094 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.08 -29.84 68.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 73.22 110.89 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.5 mp -78.82 -42.2 28.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.242 -0.435 . . . . 74.04 110.912 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.461 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 16.3 mt -64.06 -48.8 74.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 73.2 110.954 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -52.77 -34.63 54.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 72.2 110.918 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 29.3 m -93.66 -13.95 8.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 74.33 111.114 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.5 OUTLIER -77.62 -40.2 42.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.111 -0.495 . . . . 72.21 110.899 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -50.03 -31.1 12.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 72.41 110.852 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.51 -20.63 18.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.134 -0.485 . . . . 74.04 110.929 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 50.3 m-70 -129.01 89.56 48.29 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.643 0.735 . . . . 63.5 110.854 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.72 1.05 4.76 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.703 2.269 . . . . 63.34 112.334 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -114.53 -12.51 12.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 74.54 110.932 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.8 tp -53.85 -47.76 70.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.082 -0.508 . . . . 73.41 110.979 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.422 ' HA ' HG12 ' A' ' 130' ' ' ILE . 2.6 pt? -50.5 -29.21 9.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 64.0 110.955 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.454 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.59 -26.68 24.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.183 -0.462 . . . . 73.41 110.873 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -95.52 4.1 53.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.446 . . . . 74.2 110.917 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.422 HG12 ' HA ' ' A' ' 127' ' ' LEU . 12.3 pt -123.16 -34.7 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 75.14 111.121 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.454 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 2.8 ptt-85 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 73.22 110.902 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 mmt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.864 0.364 . . . . 71.03 110.85 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.67 -168.81 0.39 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.272 -0.422 . . . . 75.44 110.877 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 p -179.45 61.18 0.12 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.579 0.704 . . . . 74.45 110.847 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.73 -5.41 16.12 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.706 2.271 . . . . 74.04 112.319 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.7 t -72.0 -60.52 2.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 73.21 111.132 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.23 -17.91 6.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 74.21 110.906 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 63.85 72.57 0.46 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 72.33 110.87 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -131.29 -75.55 0.52 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.146 -0.479 . . . . 75.22 110.934 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -94.3 -117.22 2.85 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.727 -0.749 . . . . 73.12 112.515 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -170.84 93.94 0.19 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.86 0.362 . . . . 72.33 110.891 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.512 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -59.23 103.06 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.466 . . . . 75.52 110.852 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.7 p -144.28 129.32 14.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.282 -0.417 . . . . 74.24 111.169 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.9 p -48.31 131.8 16.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.147 -0.479 . . . . 73.31 110.813 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.42 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.98 79.72 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.748 -0.739 . . . . 74.04 112.46 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.42 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.0 144.85 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.913 0.387 . . . . 74.44 111.115 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.08 -165.61 1.76 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.475 . . . . 73.34 110.889 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -94.62 116.91 29.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 75.12 110.911 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.9 mm -108.83 90.76 7.99 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.652 0.739 . . . . 74.22 111.134 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 96.93 0.61 Allowed 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.72 2.28 . . . . 72.51 112.332 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -64.98 -36.41 84.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.294 -0.412 . . . . 75.53 110.861 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.465 ' HB ' ' HA ' ' A' ' 26' ' ' LYS . 58.7 m -128.2 151.64 49.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 63.33 111.162 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -152.27 41.69 0.64 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.438 . . . . 73.4 110.908 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.56 -39.61 1.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.132 -0.485 . . . . 75.55 110.887 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -158.53 -45.14 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.76 -0.734 . . . . 64.21 112.545 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.71 44.8 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.892 0.377 . . . . 74.34 110.915 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.465 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 0.5 OUTLIER -51.75 118.66 3.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 73.32 110.908 179.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.8 t -132.91 92.36 3.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.233 -0.439 . . . . 73.42 111.12 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.1 t -76.84 128.95 37.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 73.31 111.062 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.407 ' O ' ' C ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -84.44 52.14 2.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 73.25 110.951 179.937 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.407 ' C ' ' O ' ' A' ' 29' ' ' LEU . 32.4 mttp -36.89 107.38 0.06 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 75.42 110.908 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.05 50.15 0.4 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.715 -0.755 . . . . 73.35 112.55 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.3 mm -108.89 93.14 2.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.836 0.351 . . . . 74.32 111.152 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -76.24 152.92 36.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.464 . . . . 61.35 110.817 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.96 -108.47 0.31 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.717 -0.754 . . . . 62.31 112.479 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.512 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 56.0 mt -156.92 85.98 0.97 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.816 0.341 . . . . 73.12 110.956 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -160.23 160.57 32.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 74.34 110.926 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.3 t -162.78 -41.0 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 73.4 110.885 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.3 m -127.99 -47.38 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.212 -0.449 . . . . 75.2 111.149 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -85.9 170.0 12.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.134 -0.484 . . . . 71.53 110.883 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -136.43 8.47 3.13 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.241 -0.436 . . . . 74.13 110.928 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -97.84 -63.45 1.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 73.43 110.896 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -77.03 60.96 1.91 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 65.02 110.922 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.2 p -99.65 161.98 13.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 74.12 110.816 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 23.2 mm -144.22 140.21 24.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.091 -0.504 . . . . 74.12 111.055 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.6 mtm -144.89 129.98 18.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.138 -0.483 . . . . 73.43 110.92 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.7 m-20 -83.38 -169.79 2.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 64.13 110.877 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.62 -57.8 10.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 74.35 110.877 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -56.16 22.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.439 . . . . 75.02 110.905 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.64 -60.1 3.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.12 -0.491 . . . . 73.14 110.973 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.3 t -54.2 -39.38 66.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 73.11 110.834 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.44 -45.88 87.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.097 -0.501 . . . . 72.14 110.924 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.74 -59.29 4.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 74.22 111.1 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -53.42 -48.37 68.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.226 -0.443 . . . . 75.51 110.861 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.93 -48.66 77.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 72.25 110.834 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.16 -41.28 62.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.288 -0.414 . . . . 64.21 111.109 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -70.6 -66.81 0.56 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.175 -0.466 . . . . 74.14 110.893 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 13.5 m -47.28 -36.38 4.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.247 -0.433 . . . . 74.13 111.078 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -69.35 -52.94 22.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 73.22 110.865 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.56 -49.84 55.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.445 . . . . 72.22 111.122 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -65.86 -49.26 68.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.285 -0.416 . . . . 75.13 110.816 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -48.98 -44.03 40.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 73.13 110.834 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.88 -56.45 7.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 75.13 111.081 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -50.43 -43.3 54.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 54.3 110.882 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.0 p -77.84 -24.48 14.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.113 -0.494 . . . . 72.52 111.143 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -17.51 53.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.179 -0.464 . . . . 74.43 110.893 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.24 -19.6 61.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.116 -0.493 . . . . 75.05 111.151 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -50.98 -75.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.184 -0.462 . . . . 75.41 110.937 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 81.9 m -120.01 -77.99 0.59 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.092 -0.504 . . . . 74.54 111.122 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 4.7 m -139.51 -177.82 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.457 . . . . 73.32 111.144 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -104.56 159.59 28.82 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.598 0.713 . . . . 64.23 111.143 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 -6.86 19.61 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.671 2.248 . . . . 72.52 112.385 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.93 -40.99 10.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 71.53 110.884 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -56.71 -61.13 2.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.476 . . . . 71.33 110.885 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -44.28 -68.87 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 74.21 111.176 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.1 m -48.73 -38.7 10.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.456 . . . . 75.25 111.109 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.1 mtmt -60.18 -40.17 89.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 75.23 110.845 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 82.3 t -69.58 -38.18 76.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 74.5 111.174 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -68.27 -35.39 77.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 72.44 110.882 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.0 pttt -88.06 -19.33 27.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.485 . . . . 74.11 110.923 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.74 -51.73 13.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.446 . . . . 71.23 110.899 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.8 mt -92.21 14.58 15.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.449 . . . . 75.3 110.842 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.3 m 50.58 43.45 27.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 64.43 110.825 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -78.68 86.21 4.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.129 -0.487 . . . . 74.32 110.909 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.91 156.04 0.16 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.203 -0.453 . . . . 70.51 111.049 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -57.73 -22.49 46.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 75.24 110.881 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -79.85 -52.31 8.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 75.15 110.814 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -62.67 -56.16 20.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.265 -0.425 . . . . 72.55 110.861 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -52.6 -34.32 50.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 73.15 111.127 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 91.9 p -80.95 -27.71 35.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.2 -0.454 . . . . 64.13 110.849 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -80.52 -26.66 37.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.48 . . . . 73.53 110.938 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 22.4 mm -101.29 -56.46 5.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.133 -0.485 . . . . 75.43 111.119 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -80.86 -62.93 1.52 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 75.43 110.933 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 110.95 52.38 0.57 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.692 -0.766 . . . . 63.14 112.469 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -80.71 -40.98 11.43 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.762 -0.733 . . . . 41.52 112.509 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 101.96 -179.87 27.55 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.746 -0.74 . . . . 74.32 112.513 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 5.3 p -67.08 -50.55 62.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.822 0.344 . . . . 63.43 111.167 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -86.24 31.9 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 71.14 110.937 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.63 -75.9 0.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 74.33 111.08 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -39.72 -47.34 2.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 75.24 110.87 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 40.2 t -56.92 -74.78 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 74.31 110.921 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 36.7 mtt180 -47.07 -54.48 10.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.124 -0.489 . . . . 75.44 110.87 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -49.83 -37.68 31.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.45 . . . . 73.52 110.863 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -55.43 -40.65 71.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 74.53 110.904 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.26 -17.34 26.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 74.44 110.871 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.96 25.7 18.99 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.768 -0.729 . . . . 73.05 112.498 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -93.46 -27.66 16.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.831 0.348 . . . . 71.42 110.816 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -100.61 18.7 18.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 43.5 111.083 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.528 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.1 tm0? -121.65 53.74 4.23 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.62 0.724 . . . . 71.15 110.889 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 54.0 Cg_endo -69.81 28.51 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.668 2.245 . . . . 75.43 112.347 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.718 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.9 m170 70.2 36.87 0.12 Allowed Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.577 0.703 . . . . 74.34 110.88 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.718 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.5 Cg_endo -69.71 -165.37 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.64 2.227 . . . . 74.13 112.405 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.0 p -83.05 -32.64 26.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.267 -0.424 . . . . 63.14 110.913 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 18.5 m -49.17 -43.48 42.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.144 -0.48 . . . . 73.42 111.167 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 24.7 mm -58.96 -44.4 90.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 75.11 111.082 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.47 -28.85 69.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.466 . . . . 73.22 110.89 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.5 mp -81.14 -42.52 20.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.266 -0.424 . . . . 74.04 110.978 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.43 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 18.2 mt -61.54 -49.28 77.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 73.2 110.852 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 15.7 ptp180 -52.11 -39.41 59.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 72.2 110.864 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 33.8 m -88.34 -13.4 9.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.226 -0.443 . . . . 74.33 111.128 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.4 OUTLIER -78.54 -39.88 36.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.162 -0.472 . . . . 72.21 110.923 179.979 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.16 -31.33 13.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 72.41 110.881 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.43 -19.49 18.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.151 -0.477 . . . . 74.04 110.963 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 46.5 m-70 -130.05 88.46 48.41 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.613 0.72 . . . . 63.5 110.867 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.83 2.74 3.3 Favored 'Trans proline' 0 C--N 1.342 0.231 0 C-N-CA 122.652 2.235 . . . . 63.34 112.311 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -116.83 -11.68 10.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.274 -0.421 . . . . 74.54 110.837 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.4 tp -53.85 -46.38 71.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 73.41 110.883 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.412 ' HA ' HG12 ' A' ' 130' ' ' ILE . 1.6 pt? -50.11 -29.24 8.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 64.0 110.869 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.495 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.8 m-80 -86.57 -27.48 23.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 73.41 110.928 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -94.54 4.58 53.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.19 -0.459 . . . . 74.2 110.919 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.412 HG12 ' HA ' ' A' ' 127' ' ' LEU . 12.0 pt -123.84 -35.1 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 75.14 111.146 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.495 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 73.22 110.936 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 mmt . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.836 0.351 . . . . 71.03 110.849 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.56 -169.49 0.44 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.246 -0.434 . . . . 75.44 110.893 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 1.7 p 178.7 55.67 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.385 0 CA-C-O 121.516 0.674 . . . . 74.45 110.899 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 53.4 Cg_endo -69.79 -8.67 24.2 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.709 2.272 . . . . 74.04 112.277 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.8 m -67.45 -49.56 70.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 73.21 111.132 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.2 m -133.19 -20.96 2.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.171 -0.468 . . . . 74.21 110.893 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 66.65 89.01 0.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.216 -0.447 . . . . 72.33 110.909 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.619 HE21 ' N ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -132.26 -65.85 0.72 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 75.22 110.94 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -129.55 -96.0 0.78 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.745 -0.74 . . . . 73.12 112.441 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -177.0 95.28 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.87 0.367 . . . . 72.33 110.86 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.54 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -62.45 102.94 0.36 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 75.52 110.909 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.7 p -144.28 129.22 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.28 -0.418 . . . . 74.24 111.166 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -48.65 130.28 17.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.154 -0.476 . . . . 73.31 110.861 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.421 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.66 80.71 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.752 -0.737 . . . . 74.04 112.487 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.421 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.3 146.21 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.851 0.358 . . . . 74.44 111.125 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.1 -165.49 1.73 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.123 -0.489 . . . . 73.34 110.914 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.62 117.76 31.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.265 -0.425 . . . . 75.12 110.846 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.4 mm -108.21 91.42 8.07 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.623 0.725 . . . . 74.22 111.13 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 96.76 0.6 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.662 2.241 . . . . 72.51 112.322 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -63.11 -37.69 88.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.198 -0.455 . . . . 75.53 110.882 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.0 m -127.55 146.97 50.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 63.33 111.153 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -142.86 38.5 1.47 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.46 . . . . 73.4 110.86 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.64 -40.42 1.4 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.192 -0.458 . . . . 75.55 110.854 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -156.41 -58.98 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.691 -0.766 . . . . 64.21 112.459 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.28 47.04 1.39 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.872 0.367 . . . . 74.34 110.926 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.8 tttm -54.61 113.35 1.27 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 73.32 110.936 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.8 t -127.13 92.68 3.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.241 -0.436 . . . . 73.42 111.092 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 44.3 t -77.06 126.87 38.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 73.31 111.133 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.41 ' O ' ' C ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -84.64 51.19 2.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 73.25 110.921 179.975 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.41 ' C ' ' O ' ' A' ' 29' ' ' LEU . 22.8 mttp -37.73 108.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.466 . . . . 75.42 110.851 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.48 47.02 0.43 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.716 -0.754 . . . . 73.35 112.473 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 15.5 mm -107.92 90.95 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.824 0.345 . . . . 74.32 111.168 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.54 153.97 40.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.195 -0.457 . . . . 61.35 110.865 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.46 -109.0 0.32 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.714 -0.755 . . . . 62.31 112.445 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.54 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 56.0 mt -156.79 86.29 0.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.857 0.36 . . . . 73.12 110.885 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -160.34 163.16 33.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 74.34 110.854 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.1 t -164.31 -39.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 73.4 110.967 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 15.7 m -131.1 -44.57 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.133 -0.485 . . . . 75.2 111.115 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.47 169.7 11.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 71.53 110.787 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 98.2 m -134.94 7.14 3.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.153 -0.476 . . . . 74.13 110.934 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -94.03 -65.07 1.01 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.176 -0.465 . . . . 73.43 110.895 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -76.21 61.29 1.59 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.133 -0.485 . . . . 65.02 110.929 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.9 p -100.13 158.4 15.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 74.12 110.902 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 20.6 mm -145.33 140.17 22.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 74.12 111.133 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.5 mtt -143.37 140.55 30.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 73.43 110.848 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 35.5 m-20 -88.54 -169.88 2.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 64.13 110.861 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -61.13 2.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.179 -0.464 . . . . 74.35 110.867 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.26 -57.29 9.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 75.02 110.846 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.04 -58.25 6.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 73.14 110.866 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.8 t -53.48 -42.2 67.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 73.11 110.844 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -57.46 -45.02 85.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.146 -0.479 . . . . 72.14 110.866 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.03 -61.71 2.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 74.22 111.114 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -52.6 -48.59 66.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 75.51 110.779 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -48.9 78.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.245 -0.434 . . . . 72.25 110.878 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.79 -43.27 62.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.236 -0.438 . . . . 64.21 111.128 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -68.76 -66.6 0.55 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 74.14 110.945 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.0 m -47.5 -36.71 4.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.13 -0.486 . . . . 74.13 111.113 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 mmmt -67.02 -55.96 12.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 73.22 110.906 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.29 -53.05 23.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 72.22 111.145 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.85 -48.53 78.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 75.13 110.965 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -50.25 -38.47 40.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.126 -0.488 . . . . 73.13 110.855 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.67 -53.67 12.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.139 -0.482 . . . . 75.13 111.103 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.1 -26.95 63.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.152 -0.477 . . . . 54.3 110.864 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.0 m -93.87 -19.56 6.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 72.52 111.109 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.84 -19.41 41.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 74.43 110.887 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.81 -22.18 34.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 75.05 111.108 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -50.35 -75.64 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.209 -0.45 . . . . 75.41 110.845 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 97.6 m -128.26 -78.1 0.57 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 74.54 111.169 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 16.8 m -145.19 178.0 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 73.32 111.135 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -100.81 159.91 28.24 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.542 0.687 . . . . 64.23 111.132 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.7 -6.78 19.4 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.657 2.238 . . . . 72.52 112.339 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -92.34 -40.24 11.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.271 -0.422 . . . . 71.53 110.841 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -57.77 -60.75 3.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 71.33 110.85 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -44.18 -68.46 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.451 . . . . 74.21 111.126 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.3 m -49.03 -39.61 12.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 75.25 111.166 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.4 mtmt -59.42 -38.54 80.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 75.23 110.934 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 98.7 t -71.11 -39.22 73.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 74.5 111.089 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.5 -30.59 68.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 72.44 110.918 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.64 -22.31 21.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.853 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -74.14 -50.88 17.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 71.23 110.953 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.1 mt -90.64 12.68 18.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 75.3 110.865 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.43 43.01 29.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 64.43 110.853 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -78.69 86.28 4.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.125 -0.489 . . . . 74.32 110.91 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -46.11 156.75 0.14 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.16 -0.473 . . . . 70.51 111.103 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -59.89 -22.69 62.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 75.24 110.905 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.1 -51.06 10.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 75.15 110.887 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.48 -52.75 42.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 72.55 110.843 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.95 -32.01 61.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.113 -0.494 . . . . 73.15 111.103 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.4 t -80.44 -35.08 35.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 64.13 110.869 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -76.3 -23.37 54.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 73.53 110.878 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 57.1 mt -102.09 -60.68 2.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.142 -0.481 . . . . 75.43 111.16 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -78.51 -63.49 1.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.485 . . . . 75.43 110.903 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 111.32 47.17 0.76 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.8 -0.715 . . . . 63.14 112.466 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -69.21 -46.88 56.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.721 -0.752 . . . . 41.52 112.488 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 111.45 169.53 18.75 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.689 -0.767 . . . . 74.32 112.48 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -51.22 -66.6 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.912 0.387 . . . . 63.43 111.222 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -86.07 40.67 0.88 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.099 -0.5 . . . . 71.14 110.876 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.76 -73.6 0.1 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 74.33 111.095 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -40.28 -46.21 2.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.465 . . . . 75.24 110.912 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.3 m -56.46 -74.74 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.087 -0.506 . . . . 74.31 110.902 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 10.1 mtt85 -48.38 -52.79 20.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.08 -0.509 . . . . 75.44 110.867 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -50.76 -36.27 35.91 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.216 -0.447 . . . . 73.52 110.925 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -56.12 -39.7 72.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 74.53 110.862 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.74 -17.64 23.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 74.44 110.948 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.0 27.15 14.33 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.747 -0.74 . . . . 73.05 112.502 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.1 m-20 -96.38 -20.57 18.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.794 0.331 . . . . 71.42 110.911 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -108.54 17.35 22.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.09 -0.505 . . . . 43.5 111.151 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.516 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.4 tm0? -120.56 54.56 3.7 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.63 0.729 . . . . 71.15 110.935 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.429 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 54.1 Cg_endo -69.77 31.64 0.19 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.686 2.257 . . . . 75.43 112.361 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.696 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.0 m-70 69.02 38.46 0.18 Allowed Pre-proline 0 C--N 1.331 -0.237 0 CA-C-O 121.557 0.694 . . . . 74.34 110.854 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.696 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.5 Cg_endo -69.83 -165.71 0.16 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.619 2.212 . . . . 74.13 112.354 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 12.0 m -83.65 -33.54 25.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.237 -0.438 . . . . 63.14 110.904 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 15.5 m -48.87 -40.79 31.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.107 -0.497 . . . . 73.42 111.174 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 27.2 mm -61.08 -43.8 96.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 75.11 111.183 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.08 -28.91 69.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.084 -0.507 . . . . 73.22 110.843 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.5 mp -81.46 -42.98 19.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.231 -0.441 . . . . 74.04 110.911 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.439 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 30.2 mt -62.02 -49.36 76.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.185 -0.461 . . . . 73.2 110.856 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -51.61 -38.48 54.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 72.2 110.886 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 33.3 m -89.68 -13.99 9.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.169 -0.469 . . . . 74.33 111.134 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.439 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.3 OUTLIER -77.62 -40.82 40.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 72.21 110.89 -179.993 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -49.32 -31.98 10.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.199 -0.455 . . . . 72.41 110.926 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.46 -21.2 17.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.147 -0.479 . . . . 74.04 110.884 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 31.8 m-70 -127.56 88.21 54.2 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.606 0.717 . . . . 63.5 110.871 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 3.53 2.71 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.716 2.277 . . . . 63.34 112.37 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -117.24 -12.69 10.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 74.54 110.937 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.11 -46.79 72.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 73.41 110.954 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.41 ' O ' ' HB3' ' A' ' 131' ' ' ARG . 1.7 pt? -49.41 -29.68 6.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.489 . . . . 64.0 110.903 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.477 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.27 -28.6 23.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 73.41 110.886 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.18 4.68 53.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.45 . . . . 74.2 110.91 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 12.1 pt -123.81 -35.01 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 75.14 111.14 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.477 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 2.1 ptt-85 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 73.22 110.841 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mmt . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.835 0.35 . . . . 71.03 110.871 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.82 -169.39 0.41 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 75.44 110.846 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.9 p 175.92 58.66 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.614 0.721 . . . . 74.45 110.924 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 1.15 4.67 Favored 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.698 2.265 . . . . 74.04 112.349 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.6 m -89.59 -41.97 14.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 73.21 111.213 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -125.45 -31.37 3.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.152 -0.476 . . . . 74.21 110.896 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 66.6 53.42 0.93 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 72.33 110.85 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 85.7 mm-40 -112.38 -76.08 0.6 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.247 -0.433 . . . . 75.22 110.882 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.91 -109.47 3.27 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.702 -0.761 . . . . 73.12 112.449 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -177.46 98.3 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.888 0.375 . . . . 72.33 110.87 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.54 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -55.72 106.56 0.26 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.09 -0.505 . . . . 75.52 110.873 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.1 p -149.16 130.67 5.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 74.24 111.161 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -45.93 127.98 8.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.433 . . . . 73.31 110.893 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.97 79.79 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.707 -0.758 . . . . 74.04 112.491 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -36.97 146.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.881 0.372 . . . . 74.44 111.092 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.58 -168.28 2.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.187 -0.46 . . . . 73.34 110.909 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -93.98 116.21 28.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 75.12 110.889 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' A' ' 28' ' ' VAL . 8.2 mm -107.98 90.66 6.8 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.572 0.701 . . . . 74.22 111.157 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.452 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.75 104.19 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.657 2.238 . . . . 72.51 112.383 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -70.87 -30.97 67.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 75.53 110.926 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 21.6 m -128.21 147.44 50.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 63.33 111.167 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -146.35 30.49 1.02 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 73.4 110.884 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.63 -44.81 2.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.116 -0.493 . . . . 75.55 110.878 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -151.22 -58.08 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.774 -0.727 . . . . 64.21 112.473 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.73 45.46 1.23 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.381 . . . . 74.34 110.869 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.1 tttm -49.66 110.85 0.42 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 73.32 110.872 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.2 t -132.13 93.28 3.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 73.42 111.131 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.452 ' HA ' ' HA ' ' A' ' 19' ' ' PRO . 0.8 OUTLIER -80.82 139.83 17.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 73.31 111.13 179.924 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.428 ' HG ' ' HB2' ' A' ' 56' ' ' GLN . 0.2 OUTLIER -86.09 63.6 8.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 73.25 110.921 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.0 mttp -42.26 104.55 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 75.42 110.918 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.42 60.49 0.3 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.759 -0.734 . . . . 73.35 112.495 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.421 HG12 ' O ' ' A' ' 29' ' ' LEU . 18.2 mm -116.78 92.34 2.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.807 0.337 . . . . 74.32 111.135 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.52 156.66 36.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.274 -0.421 . . . . 61.35 110.828 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 164.53 -107.66 0.31 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.713 -0.755 . . . . 62.31 112.464 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.54 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 49.8 mt -156.47 83.33 0.98 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.91 0.385 . . . . 73.12 110.916 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.428 ' CD1' ' N ' ' A' ' 36' ' ' TYR . 0.1 OUTLIER -165.66 168.79 15.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 74.34 110.935 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.1 t -177.06 -35.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 73.4 110.879 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.69 -49.01 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 75.2 111.134 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.79 173.93 7.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 71.53 110.786 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.8 p -147.8 36.3 0.86 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 74.13 110.843 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -112.36 -75.67 0.6 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 73.43 110.913 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -79.06 60.4 2.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 65.02 110.912 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.2 p -83.73 159.48 21.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.463 . . . . 74.12 110.837 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 28.4 mm -142.76 140.65 27.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.056 -0.52 . . . . 74.12 111.123 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.1 mtt -145.66 141.16 27.85 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 73.43 110.88 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.0 m-20 -86.07 -169.93 2.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 64.13 110.908 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 6.6 mmpt? -57.8 -59.62 4.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 74.35 110.878 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.93 -57.76 8.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.26 -0.427 . . . . 75.02 110.925 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.58 -59.03 4.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.19 -0.459 . . . . 73.14 110.882 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.6 t -52.79 -38.22 60.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.134 -0.485 . . . . 73.11 110.871 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.54 -43.24 99.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.096 -0.502 . . . . 72.14 110.902 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.89 -58.78 5.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 74.22 111.073 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -53.63 -47.64 70.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.251 -0.431 . . . . 75.51 110.937 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -50.98 67.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.117 -0.492 . . . . 72.25 110.877 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.02 -40.57 58.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 64.21 111.071 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.428 ' HB2' ' HG ' ' A' ' 29' ' ' LEU . 3.4 mt-30 -70.29 -67.48 0.49 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 74.14 110.876 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 9.3 m -48.01 -34.58 4.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.227 -0.442 . . . . 74.13 111.13 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.3 mmmm -69.19 -56.71 6.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 73.22 110.882 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -48.99 -51.89 28.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.248 -0.433 . . . . 72.22 111.07 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.83 -48.66 78.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.263 -0.426 . . . . 75.13 110.853 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.54 -37.57 40.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.494 . . . . 73.13 110.866 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.0 -52.82 15.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 75.13 111.133 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.46 -31.31 67.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 54.3 110.791 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.9 m -91.45 -16.54 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 72.52 111.087 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.91 -17.82 58.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 74.43 110.833 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -82.16 -18.45 42.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.435 . . . . 75.05 111.155 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -51.72 -75.19 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 75.41 110.866 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 97.2 m -53.04 -76.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 74.54 111.162 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 14.7 m -135.85 -172.4 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.208 -0.451 . . . . 73.32 111.166 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -106.71 159.39 30.03 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.535 0.684 . . . . 64.23 111.124 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -7.81 22.01 Favored 'Trans proline' 0 C--N 1.341 0.132 0 C-N-CA 122.681 2.254 . . . . 72.52 112.367 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -95.77 -38.36 10.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.23 -0.441 . . . . 71.53 110.917 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -55.71 -61.6 2.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.126 -0.488 . . . . 71.33 110.859 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -44.42 -68.68 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.165 -0.47 . . . . 74.21 111.094 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.6 m -48.88 -39.03 11.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 75.25 111.149 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -60.82 -38.52 85.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 75.23 110.966 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 97.3 t -70.63 -38.29 72.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.455 . . . . 74.5 111.111 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 78' ' ' ARG . 1.1 mtp180 -69.58 -32.63 71.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 72.44 110.85 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.57 -18.97 24.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 74.11 110.877 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -76.1 -51.46 12.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.276 -0.42 . . . . 71.23 110.916 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.5 mt -91.39 14.44 14.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 75.3 110.905 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.49 42.91 29.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.464 . . . . 64.43 110.904 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -78.71 84.36 4.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 74.32 110.895 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.78 155.92 0.23 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 70.51 111.177 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -57.82 -22.52 47.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 75.24 110.936 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.17 -53.31 7.1 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.174 -0.467 . . . . 75.15 110.869 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.42 -55.68 19.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 72.55 110.936 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.22 -35.9 39.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 73.15 111.094 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 94.5 p -78.61 -32.24 47.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 64.13 110.82 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -74.62 -28.52 60.92 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.123 -0.49 . . . . 73.53 110.906 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 17.3 mm -99.9 -61.75 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 75.43 111.11 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -73.42 -63.46 1.19 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 75.43 110.882 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 117.51 37.94 0.88 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.765 -0.731 . . . . 63.14 112.549 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -57.54 -52.18 53.41 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.782 -0.723 . . . . 41.52 112.463 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.11 -154.49 16.62 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.698 -0.763 . . . . 74.32 112.556 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.6 t -85.14 -67.2 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.882 0.372 . . . . 63.43 111.065 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -82.11 36.18 0.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.443 . . . . 71.14 110.923 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.38 -78.77 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.5 . . . . 74.33 111.076 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -38.09 -43.05 0.71 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 75.24 110.913 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.2 t -57.39 -76.6 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 74.31 110.929 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -50.06 -48.97 52.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.481 . . . . 75.44 110.861 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -52.22 -36.33 51.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.144 -0.48 . . . . 73.52 110.911 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -55.73 -31.67 62.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.065 -0.516 . . . . 74.53 110.876 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.44 -17.21 15.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 74.44 110.899 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.18 26.65 15.44 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.773 -0.727 . . . . 73.05 112.517 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -99.04 -2.82 36.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.848 0.356 . . . . 71.42 110.839 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.95 17.09 10.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 43.5 111.139 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.461 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -126.34 55.21 13.0 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.535 0.684 . . . . 71.15 110.871 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.476 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.9 Cg_endo -69.74 39.09 0.27 Allowed 'Trans proline' 0 C--N 1.341 0.135 0 C-N-CA 122.619 2.213 . . . . 75.43 112.424 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.734 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.3 m170 70.96 35.31 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.618 0.723 . . . . 74.34 110.861 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.734 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.5 Cg_endo -69.69 -164.15 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.765 2.31 . . . . 74.13 112.348 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.29 -27.27 22.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 63.14 110.844 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 48.1 m -58.74 -41.28 86.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.078 -0.51 . . . . 73.42 111.161 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 46.3 mm -61.76 -46.31 96.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 75.11 111.13 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.45 -29.05 69.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.136 -0.484 . . . . 73.22 110.911 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.407 ' HG ' HD12 ' A' ' 130' ' ' ILE . 5.7 mp -79.64 -42.35 25.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.192 -0.458 . . . . 74.04 110.845 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.455 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 26.9 mt -62.97 -48.57 78.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 73.2 110.931 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 15.3 ptp180 -53.05 -35.2 59.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 72.2 110.884 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 30.6 m -93.45 -12.8 8.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 74.33 111.066 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.455 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.5 OUTLIER -79.02 -39.21 34.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 72.21 110.897 -179.989 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.61 -30.39 13.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.244 -0.435 . . . . 72.41 110.801 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.15 -19.42 17.92 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.204 -0.453 . . . . 74.04 110.89 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 46.5 m-70 -130.27 88.29 48.28 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.544 0.687 . . . . 63.5 110.837 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.69 2.57 3.37 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.724 2.283 . . . . 63.34 112.351 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -116.81 -11.52 10.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.225 -0.443 . . . . 74.54 110.925 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.5 tp -53.87 -46.32 71.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.108 -0.496 . . . . 73.41 110.884 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.415 ' HA ' HG12 ' A' ' 130' ' ' ILE . 1.7 pt? -49.97 -29.65 8.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.471 . . . . 64.0 110.922 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.49 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.34 -27.8 24.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.448 . . . . 73.41 110.878 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.59 3.69 55.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.185 -0.461 . . . . 74.2 110.914 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.415 HG12 ' HA ' ' A' ' 127' ' ' LEU . 13.7 pt -122.6 -34.82 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.496 . . . . 75.14 111.124 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.49 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 73.22 110.833 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.9 mmt . . . . . 0 N--CA 1.458 -0.063 0 CA-C-O 120.841 0.353 . . . . 71.03 110.88 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.7 -169.31 0.42 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 75.44 110.915 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 p 176.73 58.26 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.636 0.731 . . . . 74.45 110.91 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.82 3.66 2.67 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.653 2.235 . . . . 74.04 112.247 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.5 m -95.05 -42.46 12.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.293 -0.412 . . . . 73.21 111.131 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.62 -32.53 3.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 74.21 110.835 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.8 m-70 65.37 49.94 1.81 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.466 . . . . 72.33 110.828 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -111.18 -75.24 0.62 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.442 . . . . 75.22 110.819 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -102.08 -109.51 3.28 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.768 -0.729 . . . . 73.12 112.444 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -177.29 98.16 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.852 0.358 . . . . 72.33 110.854 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.544 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -55.78 105.85 0.21 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 75.52 110.845 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.1 p -148.28 129.93 6.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.169 -0.469 . . . . 74.24 111.141 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -45.69 125.28 5.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 73.31 110.891 -179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -178.0 81.83 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.774 -0.727 . . . . 74.04 112.564 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -38.15 148.65 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.873 0.368 . . . . 74.44 111.12 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.41 -164.84 1.44 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.189 -0.459 . . . . 73.34 110.907 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.2 116.75 29.97 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.243 -0.435 . . . . 75.12 110.867 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.2 mm -107.65 91.83 7.85 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.671 0.748 . . . . 74.22 111.086 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 96.08 0.58 Allowed 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.693 2.262 . . . . 72.51 112.305 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -60.76 -39.63 89.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.187 -0.461 . . . . 75.53 110.945 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.7 m -128.41 144.69 51.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.134 -0.484 . . . . 63.33 111.064 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -134.13 45.81 2.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 73.4 110.864 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.57 -68.28 0.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 75.55 110.874 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.83 -46.62 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.712 -0.756 . . . . 64.21 112.513 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.25 39.71 1.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.86 0.362 . . . . 74.34 110.891 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -52.51 118.92 3.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.161 -0.472 . . . . 73.32 110.909 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 t -132.55 93.31 3.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.254 -0.43 . . . . 73.42 111.15 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 42.9 t -77.45 126.2 37.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 73.31 111.105 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.33 51.77 2.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.108 -0.496 . . . . 73.25 110.89 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -38.83 107.03 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 75.42 110.937 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.8 45.07 0.39 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.713 -0.756 . . . . 73.35 112.465 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 14.2 mm -106.28 91.0 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.862 0.363 . . . . 74.32 111.118 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.09 158.23 34.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.103 -0.499 . . . . 61.35 110.878 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 164.81 -106.86 0.28 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.762 -0.733 . . . . 62.31 112.497 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.544 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 45.6 mt -156.68 82.71 0.96 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.824 0.345 . . . . 73.12 110.924 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -165.04 168.25 17.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 74.34 110.893 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -175.47 -36.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 73.4 110.868 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.0 -49.06 2.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 75.2 111.108 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.73 175.55 7.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 71.53 110.883 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.8 t -148.73 35.69 0.78 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 74.13 110.881 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -111.84 -75.96 0.6 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.182 -0.463 . . . . 73.43 110.909 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -77.82 60.41 2.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 65.02 110.827 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.5 p -84.34 156.97 21.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.453 . . . . 74.12 110.84 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 26.6 mm -142.96 141.07 27.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 74.12 111.15 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 12.7 mtt -144.63 142.68 30.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.206 -0.452 . . . . 73.43 110.876 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.6 m-20 -88.04 -174.85 4.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.429 . . . . 64.13 110.858 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -59.65 4.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 74.35 110.872 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.66 -58.64 5.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.317 -0.401 . . . . 75.02 110.889 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -49.62 -54.17 19.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.491 . . . . 73.14 110.89 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.1 p -55.71 -44.0 77.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.101 -0.499 . . . . 73.11 110.845 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.74 -43.45 80.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 72.14 110.839 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.1 -63.0 1.21 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.165 -0.47 . . . . 74.22 111.118 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -51.86 -46.1 64.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 75.51 110.895 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.69 -49.93 71.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.129 -0.487 . . . . 72.25 110.894 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.21 -42.38 60.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 64.21 111.059 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -69.87 -66.97 0.52 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.444 . . . . 74.14 110.889 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.9 m -47.31 -35.56 3.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 74.13 111.143 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -69.18 -54.34 15.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 73.22 110.973 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.67 -53.71 22.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 72.22 111.09 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.84 -48.14 80.35 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 75.13 110.881 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.65 -36.72 36.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 73.13 110.886 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.46 -53.62 10.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 75.13 111.07 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.23 -26.66 65.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 54.3 110.9 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 17.2 m -96.14 -16.27 7.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.487 . . . . 72.52 111.094 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.17 -20.89 29.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 74.43 110.931 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.2 -21.1 31.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 75.05 111.155 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -51.57 -30.54 21.22 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.155 -0.475 . . . . 75.41 110.867 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 80.6 m -92.03 -77.84 0.42 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 74.54 111.132 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 5.6 m -139.84 -178.36 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.204 -0.453 . . . . 73.32 111.103 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -101.21 154.88 36.92 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.575 0.702 . . . . 64.23 111.14 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -5.95 17.44 Favored 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.678 2.252 . . . . 72.52 112.332 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -93.67 -40.57 10.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.211 -0.45 . . . . 71.53 110.917 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -57.06 -62.04 2.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 71.33 110.902 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -39.8 -71.97 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 74.21 111.139 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 33.3 m -47.57 -38.73 6.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 75.25 111.142 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.82 -42.86 99.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 75.23 110.833 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.78 -40.01 87.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 74.5 111.144 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.445 HH11 ' HD2' ' A' ' 78' ' ' ARG . 1.3 mtp85 -65.71 -55.03 19.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.444 . . . . 72.44 110.881 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.8 mmtp -66.48 -22.61 66.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 74.11 110.895 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -69.99 -52.98 19.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.464 . . . . 71.23 110.912 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.0 mt -89.84 13.63 14.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 75.3 110.908 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 53.65 38.7 28.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 64.43 110.831 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -78.73 81.75 5.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 74.32 110.919 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -44.57 156.79 0.07 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.214 -0.448 . . . . 70.51 111.122 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -54.18 -24.71 19.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.16 -0.473 . . . . 75.24 110.849 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.4 mtmt -79.14 -47.54 15.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.218 -0.446 . . . . 75.15 110.926 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -65.28 -60.04 3.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.279 -0.419 . . . . 72.55 110.774 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.36 -34.92 17.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 73.15 111.085 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 84.9 p -77.78 -32.95 52.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 64.13 110.88 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -75.23 -29.98 60.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 73.53 110.882 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 17.8 mm -98.32 -63.08 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 75.43 111.1 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -73.11 -65.54 0.79 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.489 . . . . 75.43 110.896 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 125.21 32.6 0.78 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.719 -0.753 . . . . 63.14 112.459 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -51.92 -53.68 29.0 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.742 -0.742 . . . . 41.52 112.465 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 110.57 -136.23 13.44 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.687 -0.768 . . . . 74.32 112.506 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.24 -73.5 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.872 0.368 . . . . 63.43 111.127 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.64 42.66 0.98 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 71.14 110.889 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -59.7 -70.28 0.17 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.183 -0.462 . . . . 74.33 111.104 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -40.77 -48.78 3.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 75.24 110.88 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.7 m -55.13 -74.32 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 74.31 110.822 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -47.44 -55.17 9.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 75.44 110.865 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -48.56 -36.57 15.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.178 -0.465 . . . . 73.52 110.917 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -57.1 -41.98 79.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.099 -0.5 . . . . 74.53 110.863 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.39 -15.66 30.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 74.44 110.868 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.42 25.64 23.01 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.735 -0.745 . . . . 73.05 112.519 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -93.68 -22.72 18.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 71.42 110.871 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -107.03 19.45 20.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.155 -0.475 . . . . 43.5 111.046 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.53 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.0 OUTLIER -121.23 53.42 3.57 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.652 0.739 . . . . 71.15 110.905 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.0 Cg_endo -69.8 28.49 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.683 2.256 . . . . 75.43 112.286 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.711 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.8 m-70 70.38 36.98 0.12 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.566 0.698 . . . . 74.34 110.838 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.711 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.7 Cg_endo -69.68 -165.27 0.15 Allowed 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.727 2.285 . . . . 74.13 112.369 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.7 p -82.04 -33.13 30.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.039 0.447 . . . . 63.14 110.88 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 23.0 m -49.25 -43.02 42.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.028 -0.533 . . . . 73.42 111.179 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.402 HD13 ' CG ' ' A' ' 108' ' ' GLN . 27.2 mm -60.82 -47.08 94.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 75.11 111.144 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -27.7 68.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.145 -0.479 . . . . 73.22 110.942 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.4 mp -82.32 -45.64 14.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.203 -0.453 . . . . 74.04 110.848 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.406 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 14.5 mt -57.51 -46.89 83.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.44 . . . . 73.2 110.949 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 -55.62 -35.08 65.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.488 . . . . 72.2 110.849 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 33.3 m -95.54 -5.37 10.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 74.33 111.157 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.406 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.5 OUTLIER -88.84 -41.06 12.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.11 -0.496 . . . . 72.21 110.882 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -49.93 -31.82 13.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 72.41 110.876 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.11 -19.09 18.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 74.04 110.984 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 47.7 m-70 -128.61 88.24 52.73 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.539 0.685 . . . . 63.5 110.83 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 2.64 3.35 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.677 2.252 . . . . 63.34 112.357 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -115.73 -13.0 11.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.213 -0.448 . . . . 74.54 110.857 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.6 tp -54.49 -46.0 73.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.173 -0.467 . . . . 73.41 110.862 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.432 ' O ' ' HB3' ' A' ' 131' ' ' ARG . 0.8 OUTLIER -49.18 -30.12 6.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 64.0 110.931 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.423 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.2 m-80 -85.52 -29.93 23.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 73.41 110.935 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.23 4.61 51.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 74.2 110.822 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 12.3 pt -124.06 -34.94 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.202 -0.453 . . . . 75.14 111.138 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.432 ' HB3' ' O ' ' A' ' 127' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 73.22 110.84 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mtt . . . . . 0 C--O 1.23 0.043 0 CA-C-O 120.837 0.351 . . . . 71.03 110.927 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.4 -169.33 0.44 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 75.44 110.941 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.445 ' O ' ' N ' ' A' ' 7' ' ' HIS . 0.1 OUTLIER 174.88 57.99 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.569 0.7 . . . . 74.45 110.938 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.75 -0.59 7.13 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.649 2.232 . . . . 74.04 112.353 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 29.5 m -90.01 -44.33 14.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.435 . . . . 73.21 111.119 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 14.2 p -119.51 -27.65 5.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 74.21 110.88 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.445 ' N ' ' O ' ' A' ' 3' ' ' CYS . 43.6 m-70 62.63 53.67 2.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 72.33 110.868 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -119.41 -75.16 0.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 75.22 110.956 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -98.87 -133.72 8.18 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.668 -0.777 . . . . 73.12 112.51 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -156.06 87.41 1.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.863 0.363 . . . . 72.33 110.926 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.524 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -48.69 105.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 75.52 110.826 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.2 p -141.85 126.48 16.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 74.24 111.163 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.3 p -49.27 131.71 19.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 73.31 110.908 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.411 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 177.98 80.66 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.805 -0.712 . . . . 74.04 112.481 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.411 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -37.08 146.9 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.882 0.372 . . . . 74.44 111.106 -179.985 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.24 -165.1 1.51 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 73.34 110.9 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -95.64 117.21 30.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.268 -0.424 . . . . 75.12 110.89 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.2 mm -107.79 91.23 7.22 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.62 0.724 . . . . 74.22 111.124 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 96.15 0.58 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.685 2.257 . . . . 72.51 112.364 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -60.96 -35.83 77.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 75.53 110.934 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.4 m -132.37 144.38 50.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 63.33 111.187 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -133.58 45.77 2.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 73.4 110.915 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.45 -68.46 0.61 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.085 -0.507 . . . . 75.55 110.832 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.52 -47.31 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.749 -0.739 . . . . 64.21 112.529 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.24 40.8 1.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.797 0.332 . . . . 74.34 110.856 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.2 tttm -53.92 117.64 3.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.189 -0.46 . . . . 73.32 110.92 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 t -130.07 92.85 3.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 73.42 111.134 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 40.7 t -77.31 125.88 37.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 73.31 111.115 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.84 51.55 2.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 73.25 110.889 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.9 mttm -37.94 108.06 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 75.42 110.923 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.66 47.08 0.42 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.738 -0.744 . . . . 73.35 112.527 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 14.8 mm -107.99 90.95 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.856 0.36 . . . . 74.32 111.113 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.89 154.14 39.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 61.35 110.839 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 168.25 -109.37 0.34 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.716 -0.754 . . . . 62.31 112.478 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.524 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 58.4 mt -156.89 86.86 0.98 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.815 0.34 . . . . 73.12 110.894 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -159.44 160.19 34.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 74.34 110.963 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 32.2 t -171.85 -39.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.162 -0.472 . . . . 73.4 110.918 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 p -123.26 -46.6 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.121 -0.49 . . . . 75.2 111.045 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -91.82 171.03 9.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.23 -0.441 . . . . 71.53 110.846 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.84 19.8 2.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 74.13 110.892 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -110.27 -63.13 1.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.255 -0.43 . . . . 73.43 110.876 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -76.87 61.94 2.0 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.124 -0.489 . . . . 65.02 110.914 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.7 p -95.42 154.81 17.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.078 -0.51 . . . . 74.12 110.846 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 18.2 mm -142.41 139.48 29.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 74.12 111.135 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.6 mtt -141.62 145.22 34.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 73.43 110.901 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.0 m-20 -90.55 -170.51 2.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 64.13 110.873 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.24 -61.08 2.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 74.35 110.853 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -51.49 -57.43 9.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 75.02 110.878 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.29 -58.67 5.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 73.14 110.875 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.7 t -52.18 -43.94 64.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 73.11 110.873 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.92 -44.02 81.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.119 -0.491 . . . . 72.14 110.895 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.46 -63.19 1.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 74.22 111.045 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -51.63 -47.42 63.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.288 -0.414 . . . . 75.51 110.927 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -49.37 75.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 72.25 110.844 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.52 -43.11 62.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.258 -0.428 . . . . 64.21 111.153 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -69.28 -66.73 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 74.14 110.875 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 11.4 m -47.27 -37.02 4.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.277 -0.42 . . . . 74.13 111.058 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -67.17 -54.79 17.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 73.22 110.829 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.32 -52.32 28.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.441 . . . . 72.22 111.084 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.83 -50.08 68.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.281 -0.418 . . . . 75.13 110.818 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.404 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -50.41 -34.99 26.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 73.13 110.881 -179.878 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.26 -56.19 5.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 75.13 111.066 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.89 -32.21 52.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 54.3 110.81 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 61' ' ' ARG . 34.3 m -89.03 -24.79 5.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.165 -0.47 . . . . 72.52 111.131 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.87 -20.03 14.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.169 -0.469 . . . . 74.43 110.877 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -48.35 -34.3 10.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 75.05 111.107 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.09 -55.77 15.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.235 -0.438 . . . . 75.41 110.836 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 96.8 m -163.51 -78.66 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 74.54 111.148 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 16.0 m -148.93 -173.66 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.151 -0.477 . . . . 73.32 111.159 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -106.2 160.15 27.21 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.535 0.683 . . . . 64.23 111.079 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 -8.2 22.99 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.634 2.222 . . . . 72.52 112.324 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.41 -37.46 10.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 71.53 110.924 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -55.94 -59.42 4.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 71.33 110.835 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -46.27 -69.32 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.18 -0.464 . . . . 74.21 111.139 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.3 m -47.54 -38.02 5.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 75.25 111.145 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -61.59 -45.2 95.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.485 . . . . 75.23 110.916 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.6 t -63.03 -38.92 83.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.444 . . . . 74.5 111.134 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.1 OUTLIER -64.23 -54.79 27.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 72.44 110.892 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.99 -21.61 64.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 74.11 110.909 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -70.11 -53.69 16.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 71.23 110.896 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.6 mt -90.89 13.88 15.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 75.3 110.896 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 52.64 38.64 26.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 64.43 110.819 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -79.01 86.48 4.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.137 -0.483 . . . . 74.32 110.909 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.82 156.74 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 70.51 111.175 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -56.88 -22.07 34.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 75.24 110.937 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.63 -52.42 7.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 75.15 110.903 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -58.93 -55.38 35.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 72.55 110.919 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -50.85 -31.64 17.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.49 . . . . 73.15 111.067 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 7.5 p -80.97 -32.13 34.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.435 . . . . 64.13 110.899 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.77 -21.82 54.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.075 -0.511 . . . . 73.53 110.887 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 22.4 mm -107.37 -61.71 2.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.47 . . . . 75.43 111.082 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -75.91 -64.04 1.17 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 75.43 110.852 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 116.49 49.21 0.44 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.763 -0.732 . . . . 63.14 112.443 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -72.03 -36.72 60.58 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.743 -0.741 . . . . 41.52 112.516 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.03 -123.52 7.15 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.727 -0.749 . . . . 74.32 112.474 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.401 HG12 ' H ' ' A' ' 97' ' ' ASN . 0.1 OUTLIER -120.46 -62.03 2.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 63.43 111.1 -179.986 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.401 ' H ' HG12 ' A' ' 96' ' ' VAL . 12.8 p30 -85.61 39.94 0.82 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 71.14 110.914 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.425 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -60.74 -77.54 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 74.33 111.068 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.425 ' C ' ' O ' ' A' ' 98' ' ' ALA . 54.7 m-85 -35.91 -46.74 0.48 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 75.24 110.884 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -57.35 -76.4 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 74.31 110.865 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 8.9 mtt180 -47.92 -52.73 18.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 75.44 110.865 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -49.04 -38.62 24.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 73.52 110.949 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -52.79 -41.33 64.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.087 -0.506 . . . . 74.53 110.854 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.79 -17.24 24.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 74.44 110.977 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 94.08 25.51 16.78 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.757 -0.735 . . . . 73.05 112.505 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -92.89 -23.37 18.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.882 0.373 . . . . 71.42 110.938 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -103.86 17.22 24.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 43.5 111.079 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.53 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.9 OUTLIER -120.3 55.02 3.72 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.605 0.717 . . . . 71.15 110.98 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 54.1 Cg_endo -69.66 27.6 0.17 Allowed 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.633 2.222 . . . . 75.43 112.396 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.718 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.8 m-70 70.34 37.17 0.13 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.595 0.712 . . . . 74.34 110.869 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.718 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.5 Cg_endo -69.75 -165.25 0.15 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.67 2.247 . . . . 74.13 112.306 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 31.8 m -83.27 -33.44 26.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 63.14 110.818 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 23.9 m -49.09 -41.66 36.35 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.116 -0.493 . . . . 73.42 111.141 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 25.1 mm -60.6 -44.16 96.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.266 -0.425 . . . . 75.11 111.1 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.28 -29.18 70.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 73.22 110.927 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.4 mp -81.23 -43.24 19.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 74.04 110.937 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.424 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 18.5 mt -60.5 -49.06 79.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.228 -0.442 . . . . 73.2 110.939 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -52.86 -38.52 61.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 72.2 110.843 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 33.4 m -89.86 -11.08 10.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 74.33 111.094 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.5 OUTLIER -81.6 -39.87 23.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.206 -0.452 . . . . 72.21 110.925 179.927 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.85 -30.38 14.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 72.41 110.832 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -98.3 -18.3 18.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 74.04 110.956 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 -130.56 88.69 46.15 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.615 0.721 . . . . 63.5 110.879 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.77 2.61 3.38 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.707 2.272 . . . . 63.34 112.367 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -116.44 -12.22 11.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 74.54 110.859 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.5 tp -54.22 -46.64 72.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 73.41 110.862 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -49.36 -29.59 6.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 64.0 110.901 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.453 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.0 m-80 -86.16 -29.29 23.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.224 -0.444 . . . . 73.41 110.864 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -92.29 4.68 52.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 74.2 110.946 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 12.1 pt -124.04 -34.95 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.099 -0.501 . . . . 75.14 111.143 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.453 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 73.22 110.899 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mmt . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.818 0.342 . . . . 71.03 110.822 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.78 -170.73 0.5 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 75.44 110.859 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 1.7 p 178.05 56.22 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.53 0.681 . . . . 74.45 110.794 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.405 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 55.2 Cg_endo -69.72 -8.83 24.6 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.699 2.266 . . . . 74.04 112.37 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.0 m -67.21 -49.98 67.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 73.21 111.115 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.2 m -133.2 -21.1 2.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.093 -0.503 . . . . 74.21 110.845 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 66.91 88.96 0.1 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.253 -0.431 . . . . 72.33 110.87 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.61 HE21 ' N ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -132.34 -66.57 0.69 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.249 -0.432 . . . . 75.22 110.933 -179.895 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -127.37 -92.9 0.8 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.814 -0.707 . . . . 73.12 112.529 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 178.34 91.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.838 0.351 . . . . 72.33 110.845 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.542 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.0 OUTLIER -57.23 99.65 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 75.52 110.865 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -139.7 128.95 28.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 74.24 111.152 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 42.3 m -48.87 130.44 18.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.182 -0.463 . . . . 73.31 110.852 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.404 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 177.49 82.13 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.658 -0.782 . . . . 74.04 112.471 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.404 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.7 OUTLIER -37.59 147.17 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.881 0.372 . . . . 74.44 111.118 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.56 -168.61 2.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.454 . . . . 73.34 110.886 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -95.02 113.6 25.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 75.12 110.868 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.7 mm -106.67 88.5 3.5 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.609 0.719 . . . . 74.22 111.125 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.486 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 54.1 Cg_endo -69.75 99.52 0.75 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.699 2.266 . . . . 72.51 112.374 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -65.07 -32.47 74.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.279 -0.419 . . . . 75.53 110.917 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.406 ' HB ' ' HA ' ' A' ' 26' ' ' LYS . 23.5 m -130.68 147.83 52.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.129 -0.487 . . . . 63.33 111.098 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -147.7 35.14 0.85 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 73.4 110.864 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.48 -43.0 2.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 75.55 110.926 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -154.56 -52.96 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.741 -0.742 . . . . 64.21 112.504 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.51 44.77 1.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.856 0.36 . . . . 74.34 110.886 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.406 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 9.9 tttm -50.11 118.39 2.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 73.32 110.903 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.0 t -136.46 82.88 1.97 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 73.42 111.157 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.486 ' HA ' ' HA ' ' A' ' 19' ' ' PRO . 1.7 p -73.96 133.82 30.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.201 -0.454 . . . . 73.31 111.186 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' A' ' 30' ' ' LYS . 0.2 OUTLIER -84.41 53.73 2.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 73.25 110.894 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.403 ' C ' ' O ' ' A' ' 29' ' ' LEU . 13.8 mttm -37.07 105.88 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 75.42 110.895 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.47 50.8 0.36 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.736 -0.745 . . . . 73.35 112.527 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 22.9 mm -107.36 96.53 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.817 0.341 . . . . 74.32 111.115 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -77.57 153.26 33.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 61.35 110.825 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.19 -108.43 0.31 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.745 -0.74 . . . . 62.31 112.545 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.542 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 48.4 mt -156.88 85.8 0.97 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.858 0.361 . . . . 73.12 110.892 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -162.3 164.54 27.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 74.34 110.95 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 43.0 t -168.31 -38.76 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.145 -0.48 . . . . 73.4 110.9 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.1 m -128.44 -45.63 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 75.2 111.18 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.02 169.28 11.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 71.53 110.889 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 10.6 p -134.93 7.38 3.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.223 -0.444 . . . . 74.13 110.849 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -94.55 -65.02 1.01 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 73.43 110.921 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -76.49 61.56 1.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.101 -0.5 . . . . 65.02 110.885 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.3 p -99.92 158.31 15.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.091 -0.504 . . . . 74.12 110.887 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 23.9 mm -142.37 140.18 29.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.491 . . . . 74.12 111.139 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.3 mtm -145.14 132.04 20.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 73.43 110.837 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 -84.91 -170.42 3.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.443 . . . . 64.13 110.845 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -55.22 32.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 74.35 110.985 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.38 -55.57 33.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.181 -0.463 . . . . 75.02 110.836 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -52.29 -60.83 2.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 73.14 110.892 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.7 t -54.71 -38.03 66.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 73.11 110.876 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -59.15 -45.7 90.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.126 -0.488 . . . . 72.14 110.869 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.48 -57.94 7.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 74.22 111.057 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -54.16 -46.99 72.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 75.51 110.92 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.57 -50.27 67.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.14 -0.482 . . . . 72.25 110.879 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.22 -40.64 59.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 64.21 111.066 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -71.02 -67.51 0.5 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.452 . . . . 74.14 110.921 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.4 m -47.24 -35.19 3.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.179 -0.464 . . . . 74.13 111.15 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -70.97 -51.26 26.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 73.22 110.897 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.77 -49.43 62.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.263 -0.426 . . . . 72.22 111.124 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -67.0 -48.09 69.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 75.13 110.808 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.12 -50.12 49.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 73.13 110.899 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.62 -54.37 32.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 75.13 111.066 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.87 -38.81 37.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 54.3 110.881 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 37.2 t -81.86 -25.47 9.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 72.52 111.104 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -64.14 -21.61 66.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 74.43 110.852 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.46 4.1 33.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 75.05 111.176 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -104.62 -28.26 11.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 75.41 110.883 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 61.2 m -50.52 -72.64 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.119 -0.491 . . . . 74.54 111.131 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 11.5 m -138.08 -174.58 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.234 -0.439 . . . . 73.32 111.135 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -105.41 159.86 28.02 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.624 0.726 . . . . 64.23 111.101 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 -7.14 20.31 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.678 2.252 . . . . 72.52 112.379 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.98 -37.98 11.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.219 -0.446 . . . . 71.53 110.892 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -57.51 -61.61 2.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 71.33 110.879 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -44.87 -67.32 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 74.21 111.099 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.0 m -49.3 -39.12 12.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 75.25 111.099 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -60.88 -45.72 93.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 75.23 110.898 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 76.7 t -61.33 -39.12 81.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 74.5 111.167 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.08 -59.34 4.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 72.44 110.915 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -22.72 67.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.926 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -69.21 -53.13 21.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 71.23 110.905 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.6 mt -90.69 12.95 17.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 75.3 110.931 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 54.54 37.51 28.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.429 . . . . 64.43 110.871 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -80.02 87.11 5.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.109 -0.496 . . . . 74.32 110.899 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.77 157.17 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 70.51 111.142 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -57.6 -21.33 38.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 75.24 110.948 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.0 mmtp -81.3 -49.89 10.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.442 . . . . 75.15 110.914 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -62.31 -52.36 63.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.436 . . . . 72.55 110.913 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.76 -36.49 67.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 73.15 111.084 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 30.6 t -79.18 -26.34 42.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 64.13 110.856 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -81.15 -27.69 35.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 73.53 110.883 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 26.5 mm -101.11 -59.09 3.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.116 -0.493 . . . . 75.43 111.172 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -75.7 -61.29 1.97 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 75.43 110.878 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.32 48.98 0.78 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.754 -0.736 . . . . 63.14 112.471 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.61 -38.91 31.12 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.737 -0.744 . . . . 41.52 112.499 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 106.98 165.56 22.28 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.749 -0.738 . . . . 74.32 112.52 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.8 p -51.4 -51.39 24.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.896 0.379 . . . . 63.43 111.135 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -87.24 39.17 0.85 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 71.14 110.866 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.7 -76.28 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 74.33 111.108 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -43.41 -39.72 3.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.439 . . . . 75.24 110.91 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 38.9 t -59.95 -75.57 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 74.31 110.818 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 36.2 mtt180 -50.61 -45.21 57.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 75.44 110.829 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -56.25 -36.67 68.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.268 -0.423 . . . . 73.52 110.932 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -52.13 -28.99 19.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.122 -0.49 . . . . 74.53 110.854 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.77 -22.63 12.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.203 -0.453 . . . . 74.44 110.862 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.92 27.19 9.07 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.772 -0.727 . . . . 73.05 112.498 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -98.13 -6.62 31.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.791 0.329 . . . . 71.42 110.879 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -110.33 10.15 23.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 43.5 111.126 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.49 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -125.14 57.27 15.79 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.598 0.714 . . . . 71.15 110.947 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.509 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.2 Cg_endo -69.82 36.68 0.24 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.671 2.247 . . . . 75.43 112.341 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.775 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.7 OUTLIER 73.9 32.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.554 0.693 . . . . 74.34 110.835 179.918 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.775 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.6 Cg_endo -69.74 -163.99 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.764 2.31 . . . . 74.13 112.322 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.4 p -86.65 -29.4 22.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.435 . . . . 63.14 110.84 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 34.5 m -53.41 -50.76 64.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.089 -0.505 . . . . 73.42 111.112 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 43.3 mm -51.34 -42.5 27.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.264 -0.425 . . . . 75.11 111.136 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -29.86 69.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.225 -0.443 . . . . 73.22 110.868 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.7 mp -79.11 -41.64 28.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.277 -0.42 . . . . 74.04 110.886 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 14.8 mt -64.32 -49.27 72.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.149 -0.478 . . . . 73.2 110.962 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 15.3 ptp180 -51.92 -34.94 43.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 72.2 110.886 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 29.5 m -93.57 -14.74 8.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 74.33 111.194 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.477 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.5 OUTLIER -76.05 -39.33 55.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 72.21 110.966 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.67 -30.52 13.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.227 -0.442 . . . . 72.41 110.859 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -96.72 -20.01 18.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 74.04 110.886 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 65.6 m-70 -131.21 90.05 39.76 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 121.619 0.723 . . . . 63.5 110.881 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 -0.07 6.32 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.758 2.305 . . . . 63.34 112.345 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -113.48 -11.92 13.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.216 -0.447 . . . . 74.54 110.902 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 6.3 tp -53.81 -47.78 70.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.149 -0.478 . . . . 73.41 110.845 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.428 ' HA ' HG12 ' A' ' 130' ' ' ILE . 2.1 pt? -51.1 -28.95 11.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 64.0 110.934 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.47 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.73 -26.05 24.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 73.41 110.869 179.929 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -96.02 3.52 53.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 74.2 110.86 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.428 HG12 ' HA ' ' A' ' 127' ' ' LEU . 12.7 pt -122.41 -34.49 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 75.14 111.207 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.47 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 73.22 110.875 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mmt . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.843 0.354 . . . . 71.03 110.919 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.7 -169.61 0.43 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.429 . . . . 75.44 110.903 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 p 176.92 57.84 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.677 0.751 . . . . 74.45 110.872 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 3.71 2.62 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.679 2.253 . . . . 74.04 112.332 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.2 m -95.66 -42.46 12.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 73.21 111.143 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.38 -32.69 3.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.15 -0.477 . . . . 74.21 110.831 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 65.35 51.02 1.64 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 72.33 110.851 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 94.8 mm-40 -114.59 -75.42 0.59 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 75.22 110.9 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -99.18 -112.43 3.3 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.79 -0.719 . . . . 73.12 112.526 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -175.81 97.12 0.07 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.81 0.338 . . . . 72.33 110.92 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.536 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.4 ptp -55.64 106.14 0.23 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 75.52 110.895 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.3 p -148.63 129.61 5.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.218 -0.446 . . . . 74.24 111.16 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -45.3 125.21 5.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 73.31 110.844 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.9 82.17 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.759 -0.734 . . . . 74.04 112.488 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -38.34 148.87 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.864 0.364 . . . . 74.44 111.133 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.47 -164.74 1.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 73.34 110.9 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.4 116.66 30.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.211 -0.449 . . . . 75.12 110.871 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.4 mm -107.56 91.78 7.65 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.607 0.718 . . . . 74.22 111.158 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 95.81 0.56 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.751 2.301 . . . . 72.51 112.379 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -60.18 -40.39 89.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.0 0.428 . . . . 75.53 110.875 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.6 m -127.83 145.23 51.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 63.33 111.159 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -134.25 45.09 2.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 73.4 110.872 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.99 -68.44 0.63 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 75.55 110.865 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.35 -47.0 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.798 -0.715 . . . . 64.21 112.541 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.15 39.83 1.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.813 0.34 . . . . 74.34 110.852 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.8 tttm -52.96 117.92 3.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 73.32 110.904 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.8 t -131.41 93.98 3.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 73.42 111.139 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 42.0 t -77.78 126.05 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.441 . . . . 73.31 111.147 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.28 52.42 2.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.153 -0.476 . . . . 73.25 110.966 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -39.19 106.92 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 75.42 110.901 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.88 45.6 0.37 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.698 -0.763 . . . . 73.35 112.437 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 14.3 mm -106.66 90.35 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.829 0.347 . . . . 74.32 111.118 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.54 158.57 34.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 61.35 110.888 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 164.42 -106.58 0.28 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.782 -0.723 . . . . 62.31 112.513 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.536 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 47.7 mt -156.63 82.65 0.96 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.839 0.352 . . . . 73.12 110.926 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.425 ' CD1' ' N ' ' A' ' 36' ' ' TYR . 0.1 OUTLIER -165.66 169.03 15.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.454 . . . . 74.34 110.932 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -176.6 -35.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 73.4 110.927 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -123.52 -45.94 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 75.2 111.071 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -95.33 176.44 6.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.128 -0.487 . . . . 71.53 110.844 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.4 p -148.54 30.71 0.82 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.19 -0.459 . . . . 74.13 110.885 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -105.14 -76.32 0.61 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 73.43 110.9 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -78.28 60.27 2.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 65.02 110.869 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.2 p -84.23 157.82 21.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 74.12 110.879 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 24.8 mm -143.81 140.91 25.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 74.12 111.139 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.7 mtt -143.8 145.43 32.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.066 -0.516 . . . . 73.43 110.857 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 41.7 m-20 -91.52 -169.97 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 64.13 110.83 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.69 -60.73 3.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 74.35 110.892 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -51.19 -57.41 8.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 75.02 110.908 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.02 -57.92 7.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.11 -0.496 . . . . 73.14 110.915 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.0 t -53.46 -42.17 66.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.124 -0.489 . . . . 73.11 110.853 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -57.6 -44.67 85.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 72.14 110.878 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.76 -61.51 2.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 74.22 111.155 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -52.32 -47.29 66.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 75.51 110.848 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -49.6 73.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 72.25 110.835 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.44 -42.27 61.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.256 -0.429 . . . . 64.21 111.127 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -69.96 -66.67 0.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 74.14 110.886 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.0 m -47.45 -35.63 4.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.434 . . . . 74.13 111.167 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -69.04 -54.58 14.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 73.22 110.857 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.7 -54.35 19.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 72.22 111.105 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.79 -48.91 78.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 75.13 110.928 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.47 -39.44 33.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 73.13 110.839 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.52 -54.33 12.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 75.13 111.096 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.24 -31.39 63.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 54.3 110.826 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 11.2 m -88.18 -22.51 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 72.52 111.175 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -51.68 -26.27 8.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 74.43 110.859 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -75.65 -38.01 59.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 75.05 111.094 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 49.78 -168.21 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 75.41 110.807 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 54.9 m -155.72 -77.03 0.1 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.055 -0.521 . . . . 74.54 111.127 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -151.17 144.66 16.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 73.32 111.091 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.99 155.63 77.43 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.621 0.724 . . . . 64.23 111.107 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.62 -6.93 19.72 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.736 2.29 . . . . 72.52 112.347 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.17 -36.69 9.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 71.53 110.917 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -59.06 -61.72 2.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.495 . . . . 71.33 110.856 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -39.43 -69.62 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 74.21 111.134 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.7 m -49.54 -40.01 14.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.093 -0.503 . . . . 75.25 111.168 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.2 mtmt -60.92 -45.12 95.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 75.23 110.933 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 21.9 t -60.83 -39.79 83.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.146 -0.479 . . . . 74.5 111.086 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.98 -59.55 4.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 72.44 110.909 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt -63.05 -22.85 67.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 74.11 110.895 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -68.92 -52.95 24.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 71.23 110.84 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.7 mt -91.12 13.1 17.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.245 -0.434 . . . . 75.3 110.906 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.2 m 55.35 38.34 30.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.447 . . . . 64.43 110.837 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.54 86.67 5.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 74.32 110.92 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.53 157.23 0.15 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.482 . . . . 70.51 111.124 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -56.26 -21.74 25.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 75.24 110.911 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -81.97 -48.85 10.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.206 -0.452 . . . . 75.15 110.959 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -61.89 -56.88 14.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 72.55 110.886 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.78 -38.04 53.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.169 -0.469 . . . . 73.15 111.099 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 27.0 t -77.69 -26.75 50.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 64.13 110.797 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -80.85 -29.21 35.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 73.53 110.868 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 18.2 mm -99.8 -60.95 2.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 75.43 111.106 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -72.69 -60.74 2.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 75.43 110.851 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 108.72 46.36 0.97 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.734 -0.746 . . . . 63.14 112.487 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -75.55 -43.78 23.15 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.722 -0.751 . . . . 41.52 112.562 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.34 167.9 21.19 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.77 -0.729 . . . . 74.32 112.502 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.1 p -52.33 -50.02 39.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.794 0.33 . . . . 63.43 111.172 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -86.66 37.61 0.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.115 -0.493 . . . . 71.14 110.862 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.6 -75.82 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.449 . . . . 74.33 111.044 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -44.42 -40.46 5.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.259 -0.428 . . . . 75.24 110.857 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.2 m -59.68 -74.76 0.07 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 74.31 110.838 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 16.3 mtt85 -50.19 -45.77 53.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.075 -0.511 . . . . 75.44 110.85 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -56.09 -36.36 68.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.221 -0.445 . . . . 73.52 110.89 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -51.45 -29.23 15.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.473 . . . . 74.53 110.92 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -108.55 -23.02 12.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 74.44 110.921 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.09 26.54 8.8 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.723 -0.751 . . . . 73.05 112.438 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -96.99 -4.85 39.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.805 0.336 . . . . 71.42 110.888 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -112.58 8.4 19.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.216 -0.447 . . . . 43.5 111.144 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.494 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -125.2 57.1 15.42 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.577 0.703 . . . . 71.15 110.87 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.515 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.2 Cg_endo -69.82 35.88 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.679 2.253 . . . . 75.43 112.279 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.786 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 1.1 t-80 74.79 31.28 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.644 0.735 . . . . 74.34 110.887 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.786 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.9 Cg_endo -69.78 -163.78 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.707 2.272 . . . . 74.13 112.306 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.14 -29.78 24.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.17 -0.468 . . . . 63.14 110.84 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 21.9 m -53.06 -52.18 59.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 73.42 111.134 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 38.8 mm -51.11 -45.14 30.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 75.11 111.183 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -28.46 69.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 73.22 110.917 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 5.9 mp -79.53 -42.92 24.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 74.04 110.905 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.443 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 7.3 mt -62.03 -47.64 83.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 73.2 110.898 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -54.74 -34.29 62.29 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.192 -0.458 . . . . 72.2 110.903 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 32.1 m -94.59 -10.13 9.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.164 -0.471 . . . . 74.33 111.083 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.6 OUTLIER -82.57 -40.19 21.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.197 -0.456 . . . . 72.21 110.924 179.907 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -49.54 -32.79 13.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.452 . . . . 72.41 110.882 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.52 -21.13 19.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 74.04 110.905 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 -129.83 90.26 43.61 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.58 0.705 . . . . 63.5 110.911 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.71 -0.72 7.28 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.674 2.25 . . . . 63.34 112.358 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -112.2 -12.39 13.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 74.54 110.792 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 6.5 tp -53.79 -47.84 70.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.259 -0.428 . . . . 73.41 110.908 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.43 ' HA ' HG12 ' A' ' 130' ' ' ILE . 2.2 pt? -51.27 -28.67 12.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.212 -0.449 . . . . 64.0 110.905 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.469 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.87 -26.13 24.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 73.41 110.861 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -95.78 2.99 54.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 74.2 110.912 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.43 HG12 ' HA ' ' A' ' 127' ' ' LEU . 13.1 pt -121.79 -34.55 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.138 -0.483 . . . . 75.14 111.117 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.469 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.7 ptt-85 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.14 -0.482 . . . . 73.22 110.851 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.2 mmt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.827 0.346 . . . . 71.03 110.818 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.65 -170.36 0.48 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 75.44 110.898 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.7 p 177.67 57.54 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.551 0.691 . . . . 74.45 110.92 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 3.58 2.66 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.672 2.248 . . . . 74.04 112.302 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 4.9 m -96.38 -42.69 12.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.289 -0.414 . . . . 73.21 111.172 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -120.54 -33.03 3.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.475 . . . . 74.21 110.922 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 65.29 51.46 1.59 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 72.33 110.906 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 95.5 mm-40 -118.2 -75.42 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 75.22 110.949 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.51 -115.63 2.96 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.688 -0.768 . . . . 73.12 112.475 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -174.88 95.38 0.08 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.837 0.351 . . . . 72.33 110.843 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.509 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.2 ptp -54.71 105.99 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.492 . . . . 75.52 110.847 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.1 p -148.57 129.12 4.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 74.24 111.106 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -45.22 128.55 7.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.123 -0.49 . . . . 73.31 110.892 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.401 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 179.88 80.0 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.791 -0.718 . . . . 74.04 112.509 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.401 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.8 145.9 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.876 0.369 . . . . 74.44 111.126 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.23 -167.9 2.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.183 -0.462 . . . . 73.34 110.933 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -94.39 116.18 28.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 75.12 110.861 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.449 ' O ' ' HA ' ' A' ' 28' ' ' VAL . 9.3 mm -108.03 90.87 7.07 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.594 0.711 . . . . 74.22 111.128 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.441 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 53.0 Cg_endo -69.83 104.07 1.27 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.706 2.27 . . . . 72.51 112.286 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -71.49 -28.47 63.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.16 -0.473 . . . . 75.53 110.889 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.414 ' HB ' ' HA ' ' A' ' 26' ' ' LYS . 27.4 m -131.31 149.42 52.57 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.059 -0.519 . . . . 63.33 111.14 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.83 41.18 0.76 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.232 -0.44 . . . . 73.4 110.907 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -129.83 -48.45 1.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 75.55 110.927 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -146.34 -49.43 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.743 -0.741 . . . . 64.21 112.533 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.22 46.34 0.92 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.834 0.35 . . . . 74.34 110.797 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.414 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 11.3 tttt -49.52 112.14 0.6 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.263 -0.426 . . . . 73.32 110.884 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.3 t -132.81 96.11 3.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.242 -0.436 . . . . 73.42 111.182 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.449 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 0.7 OUTLIER -84.65 140.34 16.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 73.31 111.164 179.928 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.418 ' O ' HG12 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -86.58 63.7 8.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 73.25 110.929 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -42.36 104.39 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 75.42 110.913 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.53 60.47 0.3 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.706 -0.759 . . . . 73.35 112.554 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.418 HG12 ' O ' ' A' ' 29' ' ' LEU . 18.2 mm -116.63 93.05 2.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.856 0.36 . . . . 74.32 111.117 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.43 157.38 34.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 61.35 110.932 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 163.48 -106.77 0.28 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.769 -0.729 . . . . 62.31 112.533 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.509 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 49.6 mt -156.53 83.44 0.97 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.886 0.374 . . . . 73.12 110.966 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.446 ' CD1' ' N ' ' A' ' 36' ' ' TYR . 0.1 OUTLIER -167.64 169.5 11.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 74.34 110.994 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -178.88 -34.77 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.199 -0.455 . . . . 73.4 110.927 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.5 m -122.28 -44.99 2.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 75.2 111.138 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -98.53 177.45 5.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 71.53 110.862 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 29.0 p -148.47 26.51 0.94 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.209 -0.45 . . . . 74.13 110.911 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.8 mp0 -100.66 -76.75 0.55 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.138 -0.483 . . . . 73.43 110.859 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -78.38 59.54 2.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.076 -0.511 . . . . 65.02 110.923 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.2 p -84.39 159.25 20.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.072 -0.513 . . . . 74.12 110.82 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 28.2 mm -142.81 140.61 27.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.082 -0.508 . . . . 74.12 111.103 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.0 mtm -145.4 135.11 23.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 73.43 110.928 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -81.53 -170.08 2.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.294 -0.412 . . . . 64.13 110.879 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.34 -58.96 5.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 74.35 110.922 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -52.73 -56.99 11.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 75.02 110.843 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.75 -59.28 4.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 73.14 110.912 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.8 t -53.31 -38.27 63.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 73.11 110.864 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.69 -43.71 98.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 72.14 110.838 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.08 -57.5 8.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 74.22 111.008 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -55.01 -47.3 74.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.256 -0.429 . . . . 75.51 110.84 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.95 -48.87 74.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.213 -0.449 . . . . 72.25 110.916 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.97 -41.75 64.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 64.21 111.084 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.414 ' HB2' ' HG ' ' A' ' 29' ' ' LEU . 3.4 mt-30 -69.52 -66.35 0.6 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 74.14 110.904 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 27.2 m -47.4 -42.52 7.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 74.13 111.074 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.7 mmtp -64.03 -50.76 67.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 73.22 110.836 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.53 -50.71 52.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 72.22 111.099 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -67.82 -43.95 78.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.233 -0.439 . . . . 75.13 110.924 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 36.5 mtp85 -51.04 -43.95 61.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 73.13 110.895 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.33 -55.42 8.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 75.13 111.097 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.83 -37.93 53.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 54.3 110.839 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 5.2 p -84.86 -22.82 7.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 72.52 111.093 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.84 -23.99 55.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 74.43 110.9 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.42 -25.66 50.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 75.05 111.095 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -63.78 -169.83 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 75.41 110.846 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 54.1 m -134.96 -76.94 0.45 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 74.54 111.124 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -150.14 143.56 17.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 73.32 111.123 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.27 160.81 61.71 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.55 0.691 . . . . 64.23 111.071 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 -7.63 21.55 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.632 2.222 . . . . 72.52 112.413 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -101.16 -36.28 9.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 71.53 110.919 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -56.6 -61.4 2.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 71.33 110.922 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -44.33 -68.7 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 74.21 111.089 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 28.1 m -48.53 -39.23 10.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 75.25 111.143 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.1 mtmt -60.68 -39.59 88.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 75.23 110.872 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 90.2 t -70.14 -36.91 70.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.189 -0.459 . . . . 74.5 111.126 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.3 OUTLIER -69.96 -34.27 73.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.192 -0.458 . . . . 72.44 110.917 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.7 ptpt -88.73 -19.78 25.65 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.181 -0.463 . . . . 74.11 110.861 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -75.85 -50.63 14.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.258 -0.428 . . . . 71.23 110.87 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.1 mt -91.27 13.14 18.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.274 -0.421 . . . . 75.3 110.932 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 7.5 t 52.22 41.18 30.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 64.43 110.857 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -79.48 85.0 5.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 74.32 110.913 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -46.84 155.99 0.23 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 70.51 111.143 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -59.1 -20.62 55.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 75.24 110.902 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.01 -53.57 6.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 75.15 110.922 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.9 -53.79 34.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 72.55 110.885 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.49 -31.87 25.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 73.15 111.046 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 44.4 t -80.24 -39.95 28.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.266 -0.425 . . . . 64.13 110.795 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -71.69 -20.89 61.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.473 . . . . 73.53 110.861 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 53.3 mt -104.31 -64.05 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 75.43 111.098 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -74.58 -61.15 1.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 75.43 110.834 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 113.09 47.96 0.63 Allowed Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.7 -0.762 . . . . 63.14 112.494 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -68.04 -38.46 88.48 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.753 -0.737 . . . . 41.52 112.472 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 98.72 -164.94 20.98 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.768 -0.73 . . . . 74.32 112.489 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 5.2 t -71.41 -70.71 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.805 0.336 . . . . 63.43 111.107 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 26.1 t30 -84.87 39.41 0.75 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 71.14 110.847 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.54 -71.69 0.14 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 74.33 111.016 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -41.15 -42.74 2.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 75.24 110.872 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.44 -74.72 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.162 -0.472 . . . . 74.31 110.86 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 10.0 mtt180 -48.27 -49.45 33.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.095 -0.502 . . . . 75.44 110.924 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -53.8 -37.23 63.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 73.52 110.901 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -53.36 -34.65 58.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.135 -0.484 . . . . 74.53 110.88 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.61 -19.83 16.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 74.44 110.9 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.08 26.74 11.9 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.775 -0.726 . . . . 73.05 112.444 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -98.82 -6.16 29.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.882 0.372 . . . . 71.42 110.898 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -117.44 17.58 14.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.479 . . . . 43.5 111.099 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.466 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -126.48 55.31 13.54 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.552 0.692 . . . . 71.15 110.944 -179.929 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.473 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.0 Cg_endo -69.8 38.5 0.26 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.667 2.245 . . . . 75.43 112.37 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.732 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.7 t60 71.63 34.9 0.08 OUTLIER Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 121.604 0.716 . . . . 74.34 110.88 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.732 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.1 Cg_endo -69.82 -163.88 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.184 0 C-N-CA 122.714 2.276 . . . . 74.13 112.319 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 83.9 p -86.82 -29.56 22.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 63.14 110.889 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 18.8 m -56.25 -47.19 79.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.09 -0.505 . . . . 73.42 111.114 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 47.5 mm -56.29 -44.83 80.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 75.11 111.182 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -28.97 68.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.108 -0.496 . . . . 73.22 110.892 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 5.6 mp -79.36 -42.12 26.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.259 -0.428 . . . . 74.04 110.945 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.45 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 19.3 mt -63.57 -48.84 75.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.241 -0.436 . . . . 73.2 110.917 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 15.3 ptp180 -52.61 -35.4 54.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 72.2 110.889 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 28.8 m -93.09 -13.36 8.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 74.33 111.11 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.45 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.4 OUTLIER -78.05 -40.23 39.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 72.21 110.899 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -49.95 -30.91 11.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.124 -0.489 . . . . 72.41 110.88 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.7 -20.3 17.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 74.04 110.895 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -127.98 87.73 54.89 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.557 0.694 . . . . 63.5 110.826 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 3.42 2.79 Favored 'Trans proline' 0 N--CA 1.465 -0.174 0 C-N-CA 122.686 2.258 . . . . 63.34 112.384 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -117.19 -12.75 10.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 74.54 110.859 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.3 tp -53.95 -46.91 71.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 73.41 110.919 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.402 ' HA ' HG12 ' A' ' 130' ' ' ILE . 1.7 pt? -49.48 -29.64 6.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.476 . . . . 64.0 110.872 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.481 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.42 -28.37 23.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 73.41 110.891 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.29 4.36 54.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.185 -0.461 . . . . 74.2 110.855 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.402 HG12 ' HA ' ' A' ' 127' ' ' LEU . 13.0 pt -123.24 -35.03 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 75.14 111.163 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.481 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.8 ptt-85 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.481 . . . . 73.22 110.89 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 mmt . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.882 0.373 . . . . 71.03 110.874 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.35 -169.64 0.46 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.446 . . . . 75.44 110.92 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 1.7 p 178.78 55.74 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.592 0.71 . . . . 74.45 110.891 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 53.5 Cg_endo -69.77 -8.64 24.12 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.674 2.249 . . . . 74.04 112.346 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.8 m -67.49 -49.48 70.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.198 -0.455 . . . . 73.21 111.082 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.2 m -133.3 -20.98 2.08 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.187 -0.461 . . . . 74.21 110.933 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 66.58 89.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 72.33 110.874 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.618 HE21 ' N ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -132.14 -65.89 0.72 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 75.22 110.94 -179.903 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.401 ' HA3' ' HB3' ' A' ' 39' ' ' HIS . . . -129.54 -95.4 0.77 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.739 -0.744 . . . . 73.12 112.464 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -177.67 95.3 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.805 0.336 . . . . 72.33 110.866 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.539 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -62.27 102.65 0.32 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 75.52 110.851 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.9 p -143.88 128.52 14.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 74.24 111.114 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -48.42 129.63 16.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 73.31 110.861 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.404 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 178.05 81.15 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.74 -0.743 . . . . 74.04 112.545 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.404 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.8 146.22 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.843 0.354 . . . . 74.44 111.13 -179.951 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.32 -165.48 1.59 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.138 -0.483 . . . . 73.34 110.912 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -94.24 118.21 31.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.305 -0.407 . . . . 75.12 110.92 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.1 mm -109.87 90.99 10.02 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.593 0.711 . . . . 74.22 111.158 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.84 96.29 0.59 Allowed 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.704 2.269 . . . . 72.51 112.26 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -63.18 -36.44 83.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 75.53 110.964 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.455 ' HB ' ' HA ' ' A' ' 26' ' ' LYS . 58.8 m -129.33 151.43 49.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.109 -0.496 . . . . 63.33 111.117 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -146.1 40.37 1.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 73.4 110.869 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 5.7 mtt85 -125.21 -57.37 1.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 75.55 110.856 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -145.52 -39.21 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.803 -0.713 . . . . 64.21 112.501 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.19 40.8 1.45 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.826 0.346 . . . . 74.34 110.863 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.455 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 0.7 OUTLIER -51.03 115.16 1.4 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 73.32 110.9 179.924 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.8 t -128.98 94.87 3.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.254 -0.43 . . . . 73.42 111.154 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 48.3 t -78.3 127.61 38.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 73.31 111.13 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.414 ' O ' ' C ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -84.39 51.68 2.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.124 -0.489 . . . . 73.25 110.852 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 29' ' ' LEU . 35.5 mttp -37.4 107.51 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.256 -0.429 . . . . 75.42 110.871 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.19 48.11 0.4 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.743 -0.741 . . . . 73.35 112.506 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.7 mm -108.07 92.38 2.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.842 0.353 . . . . 74.32 111.181 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.8 153.52 38.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 61.35 110.863 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.64 -108.62 0.31 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.774 -0.727 . . . . 62.31 112.459 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.539 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 48.8 mt -156.74 86.24 0.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.879 0.371 . . . . 73.12 110.898 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -160.83 162.79 32.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 74.34 110.858 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.0 t -164.7 -39.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.082 -0.508 . . . . 73.4 110.924 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 5.5 p -129.86 -44.13 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 75.2 111.123 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.401 ' HB3' ' HA3' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -90.79 169.81 10.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.203 -0.453 . . . . 71.53 110.784 179.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.2 p -134.92 6.92 3.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.485 . . . . 74.13 110.931 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -93.73 -65.3 1.0 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.474 . . . . 73.43 110.904 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -75.95 61.4 1.49 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 65.02 110.902 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.9 p -100.64 158.59 15.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 74.12 110.835 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 20.8 mm -142.81 140.01 27.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.149 -0.478 . . . . 74.12 111.114 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.7 mtt -143.75 133.88 24.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 73.43 110.889 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.3 m-20 -86.19 -169.87 2.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 64.13 110.869 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.87 -59.12 5.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 74.35 110.909 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -53.79 -56.53 16.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 75.02 110.926 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.29 -59.56 4.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.074 -0.512 . . . . 73.14 110.944 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.5 t -54.17 -39.38 66.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.486 . . . . 73.11 110.867 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.8 -45.47 89.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.128 -0.487 . . . . 72.14 110.857 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.81 -58.96 4.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.193 -0.458 . . . . 74.22 111.137 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -53.99 -47.8 71.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.189 -0.46 . . . . 75.51 110.899 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -48.77 76.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.131 -0.486 . . . . 72.25 110.901 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.25 -41.77 63.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 64.21 111.05 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -70.19 -66.62 0.57 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 74.14 110.886 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 13.5 m -47.32 -35.3 3.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 74.13 111.164 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.3 mmmt -70.29 -52.35 23.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 73.22 110.888 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.48 -50.77 59.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.251 -0.431 . . . . 72.22 111.138 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -65.14 -47.63 76.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.438 . . . . 75.13 110.834 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.11 -51.75 40.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.132 -0.485 . . . . 73.13 110.895 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.78 -54.76 34.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 75.13 111.08 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.19 -42.53 40.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 54.3 110.796 -179.712 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 37.5 t -76.56 -27.32 17.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.435 . . . . 72.52 111.143 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.91 -19.45 60.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 74.43 110.916 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.35 -21.97 64.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.47 . . . . 75.05 111.055 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -54.62 -75.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 75.41 110.922 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 93.6 m -134.42 -75.97 0.47 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.159 -0.473 . . . . 74.54 111.176 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 17.2 m -149.55 -172.95 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 73.32 111.126 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -106.3 156.93 36.08 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.589 0.709 . . . . 64.23 111.131 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.83 -7.95 22.38 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.699 2.266 . . . . 72.52 112.314 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.32 -34.68 10.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.446 . . . . 71.53 110.822 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -58.93 -61.15 2.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 71.33 110.864 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -43.91 -66.39 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.21 111.145 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.1 m -50.95 -38.64 18.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 75.25 111.068 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt -59.54 -47.8 84.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 75.23 110.912 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.5 t -60.78 -39.54 82.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.152 -0.476 . . . . 74.5 111.094 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.2 OUTLIER -62.14 -58.77 6.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 72.44 110.86 -179.936 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -19.97 65.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 74.11 110.865 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.3 ttmm -69.33 -55.83 9.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 71.23 110.853 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.1 mt -91.39 15.12 12.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.267 -0.424 . . . . 75.3 110.914 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 53.4 39.26 29.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 64.43 110.832 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.84 87.09 5.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.137 -0.483 . . . . 74.32 110.921 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.39 156.74 0.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.162 -0.472 . . . . 70.51 111.178 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -58.78 -21.47 55.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 75.24 110.902 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.47 -54.19 6.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 75.15 110.917 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.48 -53.15 60.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 72.55 110.921 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.57 -32.46 28.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.083 -0.508 . . . . 73.15 111.077 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 4.3 m -80.72 -34.44 34.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.296 -0.411 . . . . 64.13 110.856 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -76.26 -21.61 56.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.101 -0.499 . . . . 73.53 110.868 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 40.6 mt -105.65 -62.22 2.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.446 . . . . 75.43 111.113 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -75.69 -63.22 1.35 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 75.43 110.897 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 115.54 48.72 0.5 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.736 -0.745 . . . . 63.14 112.516 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -70.37 -37.06 70.15 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.738 -0.744 . . . . 41.52 112.453 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 103.87 -160.0 16.37 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.743 -0.742 . . . . 74.32 112.464 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.8 t -76.7 -69.93 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.927 0.394 . . . . 63.43 111.14 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -85.37 44.09 1.07 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.467 . . . . 71.14 110.893 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -59.05 -75.58 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 74.33 111.09 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.403 ' C ' ' O ' ' A' ' 98' ' ' ALA . 36.6 m-85 -37.75 -43.26 0.64 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.216 -0.447 . . . . 75.24 110.924 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.2 t -58.31 -75.86 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 74.31 110.859 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 20.9 mtt180 -49.45 -49.24 46.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 75.44 110.851 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -53.0 -36.21 60.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 73.52 110.916 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -52.72 -36.29 57.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 74.53 110.856 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.79 -19.6 16.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 74.44 110.903 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.78 24.46 13.35 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.768 -0.73 . . . . 73.05 112.507 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -95.58 -5.78 41.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.803 0.335 . . . . 71.42 110.876 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -115.02 17.43 16.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 43.5 111.133 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.471 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -129.49 56.03 21.86 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.603 0.716 . . . . 71.15 110.889 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.492 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.6 Cg_endo -69.75 38.67 0.26 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.734 2.289 . . . . 75.43 112.339 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.745 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER 72.05 34.21 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.547 0.689 . . . . 74.34 110.849 179.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.745 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.1 Cg_endo -69.81 -164.5 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.632 2.222 . . . . 74.13 112.34 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 4.1 p -88.94 -27.15 21.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.138 -0.483 . . . . 63.14 110.932 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 8.3 m -56.94 -49.85 74.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.058 -0.519 . . . . 73.42 111.121 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 36.5 mm -47.5 -45.75 10.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 75.11 111.169 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.39 -46.98 77.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.475 . . . . 73.22 110.818 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.454 ' O ' ' HB2' ' A' ' 120' ' ' LEU . 7.8 mp -60.16 -34.15 73.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.273 -0.421 . . . . 74.04 111.002 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 25.4 mt -69.69 -56.79 6.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 73.2 110.907 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -51.0 -34.09 27.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.152 -0.476 . . . . 72.2 110.911 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 18.6 m -87.71 -20.31 7.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.155 -0.475 . . . . 74.33 111.136 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 116' ' ' LEU . 0.5 OUTLIER -75.21 -40.51 59.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.136 -0.484 . . . . 72.21 110.891 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -49.89 -31.42 12.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 72.41 110.825 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -94.99 -21.21 18.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 74.04 110.937 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -131.37 91.69 34.3 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.626 0.727 . . . . 63.5 110.846 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 0.7 5.28 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.699 2.266 . . . . 63.34 112.316 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -114.45 -13.02 12.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.208 -0.451 . . . . 74.54 110.9 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 6.3 tp -53.06 -49.28 66.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.143 -0.481 . . . . 73.41 110.913 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -46.65 -32.55 3.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 64.0 110.956 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.39 -38.44 26.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 73.41 110.929 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -78.09 -7.59 57.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 74.2 110.891 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 7.1 pt -118.73 -17.03 7.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.164 -0.471 . . . . 75.14 111.122 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 73.22 110.903 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.81 0.338 . . . . 71.03 110.858 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.48 ' O ' ' HB2' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -174.69 -170.6 0.5 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 75.44 110.864 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 49.6 t 176.11 59.49 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.613 0.72 . . . . 74.45 110.867 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 1.04 4.82 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.638 2.225 . . . . 74.04 112.328 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.1 m -87.84 -42.63 15.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 73.21 111.136 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.2 t -126.97 -24.33 3.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 74.21 110.918 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.432 ' N ' ' O ' ' A' ' 3' ' ' CYS . 16.2 m-70 62.92 47.67 4.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 72.33 110.785 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -102.25 -75.26 0.6 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 75.22 110.914 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -110.77 -137.95 7.63 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.694 -0.765 . . . . 73.12 112.56 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -144.54 104.48 4.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.85 0.357 . . . . 72.33 110.877 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.532 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -67.43 107.25 2.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 75.52 110.914 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -146.97 130.89 9.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 74.24 111.121 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -47.99 132.24 15.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 73.31 110.895 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.41 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 177.18 79.69 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.751 -0.738 . . . . 74.04 112.514 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.41 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.88 146.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.913 0.387 . . . . 74.44 111.095 -179.941 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.09 -165.72 1.67 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 73.34 110.913 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -94.88 116.73 29.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.241 -0.436 . . . . 75.12 110.91 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.0 mm -107.93 90.74 6.81 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.616 0.722 . . . . 74.22 111.138 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 96.12 0.58 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.706 2.271 . . . . 72.51 112.332 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.0 t80 -64.58 -35.96 82.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 75.53 110.84 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.415 HG22 ' HG2' ' A' ' 25' ' ' ARG . 20.2 m -131.35 152.35 50.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.457 . . . . 63.33 111.16 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -155.29 37.64 0.39 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.257 -0.429 . . . . 73.4 110.935 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.38 -34.0 1.86 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.157 -0.474 . . . . 75.55 110.89 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -156.91 -51.0 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.741 -0.742 . . . . 64.21 112.468 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.415 ' HG2' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -107.71 53.14 0.7 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.859 0.361 . . . . 74.34 110.883 -179.859 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -56.73 121.11 9.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.487 . . . . 73.32 110.909 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.8 t -136.8 92.95 2.79 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.288 -0.415 . . . . 73.42 111.144 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 45.8 t -77.3 128.12 38.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 73.31 111.151 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.401 ' O ' ' C ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -84.67 51.88 2.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.188 -0.46 . . . . 73.25 110.908 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.401 ' C ' ' O ' ' A' ' 29' ' ' LEU . 30.5 mttp -37.25 107.24 0.06 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 75.42 110.903 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.7 50.03 0.37 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.797 -0.716 . . . . 73.35 112.526 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 19.1 mm -109.46 92.65 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.894 0.378 . . . . 74.32 111.18 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.42 154.0 37.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 61.35 110.843 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.64 -108.46 0.31 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.78 -0.724 . . . . 62.31 112.497 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.532 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 61.0 mt -156.67 86.16 0.99 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.85 0.357 . . . . 73.12 110.986 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -161.45 164.3 29.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.15 -0.477 . . . . 74.34 110.923 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 9.9 t -169.29 -44.33 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 73.4 110.835 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.0 m -120.69 -47.41 2.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 75.2 111.148 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.88 172.71 8.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 71.53 110.895 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.8 t -138.15 9.86 2.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.425 . . . . 74.13 110.951 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -97.91 -63.31 1.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 73.43 110.929 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -76.66 60.59 1.7 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.14 -0.482 . . . . 65.02 110.933 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.9 p -98.3 158.65 15.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 74.12 110.854 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 18.3 mm -144.31 139.39 24.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 74.12 111.169 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.8 mtt -142.06 137.51 31.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.192 -0.458 . . . . 73.43 110.975 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 40.9 m-20 -89.05 -169.52 2.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 64.13 110.887 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? -54.78 -59.8 4.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 74.35 110.857 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -56.84 13.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 75.02 110.905 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.02 -59.43 4.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.105 -0.498 . . . . 73.14 110.92 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.9 t -53.62 -41.23 66.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.127 -0.488 . . . . 73.11 110.89 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -57.6 -45.23 85.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 72.14 110.876 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.62 -61.04 2.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 74.22 111.084 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -52.49 -48.37 65.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 75.51 110.92 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -49.32 76.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 72.25 110.842 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.43 -41.71 61.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 64.21 111.068 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -70.18 -67.38 0.5 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.449 . . . . 74.14 110.89 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.0 m -46.98 -35.74 3.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 74.13 111.142 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -69.52 -54.25 15.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 73.22 110.92 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.25 -51.75 31.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 72.22 111.124 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.66 -49.13 74.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.167 -0.47 . . . . 75.13 110.876 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.65 -36.68 36.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.043 -0.526 . . . . 73.13 110.805 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.12 -54.01 9.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.292 -0.413 . . . . 75.13 111.06 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.29 -28.57 65.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 54.3 110.837 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 19.9 m -94.14 -17.38 7.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.147 -0.479 . . . . 72.52 111.185 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -30.98 69.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 74.43 110.935 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.91 -18.86 59.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 75.05 111.136 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -60.33 -75.22 0.06 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.223 -0.444 . . . . 75.41 110.906 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 93.1 m -53.61 -76.14 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.074 -0.512 . . . . 74.54 111.094 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 17.0 m -149.39 -172.44 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.236 -0.438 . . . . 73.32 111.054 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -105.92 155.45 38.32 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.52 0.676 . . . . 64.23 111.08 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.68 -6.93 19.74 Favored 'Trans proline' 0 N--CA 1.465 -0.156 0 C-N-CA 122.708 2.272 . . . . 72.52 112.355 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.06 -34.78 9.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 71.53 110.905 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -58.34 -61.83 2.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 71.33 110.834 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -39.54 -69.98 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.15 -0.477 . . . . 74.21 111.105 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.9 m -49.37 -39.81 13.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 75.25 111.136 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.5 mtmt -61.46 -38.29 86.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.152 -0.476 . . . . 75.23 110.894 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 16.6 t -69.81 -38.15 75.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.245 -0.434 . . . . 74.5 111.123 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.93 -33.33 72.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.138 -0.483 . . . . 72.44 110.866 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -88.05 -21.83 24.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.149 -0.478 . . . . 74.11 110.924 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -74.16 -50.5 19.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.204 -0.453 . . . . 71.23 110.897 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 12.8 mt -89.71 12.05 18.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.244 -0.434 . . . . 75.3 111.003 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 65.3 m 53.14 39.8 30.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.149 -0.478 . . . . 64.43 110.888 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -79.56 83.99 5.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.125 -0.489 . . . . 74.32 110.891 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.43 157.3 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.16 -0.473 . . . . 70.51 111.164 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -56.29 -23.19 35.07 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.245 -0.434 . . . . 75.24 110.921 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.4 mmtp -80.0 -47.1 15.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 75.15 110.916 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -67.22 -56.25 10.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.271 -0.422 . . . . 72.55 110.827 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -50.79 -38.67 49.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 73.15 111.045 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 96.6 p -77.53 -32.3 53.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 64.13 110.86 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -73.72 -28.86 61.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 73.53 110.925 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 11.4 mm -99.92 -63.59 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 75.43 111.192 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -70.08 -61.57 1.73 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.128 -0.487 . . . . 75.43 110.863 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 111.95 41.66 1.07 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.755 -0.736 . . . . 63.14 112.458 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -57.83 -44.95 94.07 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.698 -0.763 . . . . 41.52 112.495 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.69 -151.2 16.95 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.799 -0.715 . . . . 74.32 112.505 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.0 t -85.41 -69.1 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.822 0.344 . . . . 63.43 111.104 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -83.33 39.58 0.67 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 71.14 110.876 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.21 -79.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.119 -0.491 . . . . 74.33 111.112 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -37.68 -43.07 0.61 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.343 -0.39 . . . . 75.24 110.874 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.0 -76.45 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 74.31 110.833 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 55.7 mtt180 -50.09 -49.46 51.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 75.44 110.897 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -51.17 -37.35 45.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.241 -0.436 . . . . 73.52 110.88 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -51.22 -38.33 51.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 74.53 110.871 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.95 -18.56 17.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.105 -0.498 . . . . 74.44 110.902 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.94 26.32 11.71 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.723 -0.751 . . . . 73.05 112.539 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -96.37 -4.18 42.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.892 0.377 . . . . 71.42 110.911 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -120.69 18.4 11.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 43.5 111.093 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.477 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -126.28 55.91 14.9 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.661 0.743 . . . . 71.15 110.932 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.472 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.4 Cg_endo -69.74 36.51 0.23 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.698 2.266 . . . . 75.43 112.327 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.743 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 4.7 t-160 71.67 34.27 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.576 0.703 . . . . 74.34 110.881 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.743 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.3 Cg_endo -69.79 -164.26 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.648 2.232 . . . . 74.13 112.33 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 28.3 t -83.64 -30.82 26.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.145 -0.48 . . . . 63.14 110.876 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 54.1 m -54.94 -50.68 68.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.108 -0.496 . . . . 73.42 111.102 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 44.0 mm -54.21 -47.75 67.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 75.11 111.13 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -28.59 70.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.462 . . . . 73.22 110.968 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.4 ' HG ' HD13 ' A' ' 130' ' ' ILE . 5.1 mp -79.59 -42.01 25.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 74.04 110.932 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.424 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 4.4 mt -61.48 -48.55 80.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 73.2 110.917 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 15.9 ptp180 -54.06 -35.32 61.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 72.2 110.867 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 34.5 m -92.97 -10.65 9.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 74.33 111.159 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.7 OUTLIER -83.42 -39.98 19.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 72.21 110.898 179.971 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -50.33 -31.68 15.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 72.41 110.859 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.16 -19.66 19.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 74.04 110.938 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 -130.82 90.39 40.13 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.558 0.694 . . . . 63.5 110.876 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 0.39 5.69 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.664 2.243 . . . . 63.34 112.289 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -113.93 -11.91 12.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.248 -0.433 . . . . 74.54 110.874 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 6.7 tp -53.95 -47.87 70.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 73.41 110.892 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.431 ' HA ' HG12 ' A' ' 130' ' ' ILE . 2.0 pt? -51.0 -28.76 10.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 64.0 110.985 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.467 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.68 -27.21 23.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 73.41 110.892 179.9 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -94.31 2.48 55.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.475 . . . . 74.2 110.839 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.431 HG12 ' HA ' ' A' ' 127' ' ' LEU . 13.5 pt -121.12 -33.99 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 75.14 111.174 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.467 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 2.3 ptt-85 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 73.22 110.911 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.6 mmt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.877 0.37 . . . . 71.03 110.916 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.77 -169.35 0.41 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 75.44 110.902 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.4 ' O ' ' N ' ' A' ' 7' ' ' HIS . 1.6 t -179.44 58.6 0.1 Allowed Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.572 0.701 . . . . 74.45 110.861 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 3.15 2.95 Favored 'Trans proline' 0 N--CA 1.465 -0.2 0 C-N-CA 122.72 2.28 . . . . 74.04 112.389 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.6 m -107.58 -45.71 7.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.199 -0.455 . . . . 73.21 111.077 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -106.92 -33.47 7.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 74.21 110.947 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.4 ' N ' ' O ' ' A' ' 3' ' ' CYS . 58.6 m-70 59.48 24.85 13.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.14 -0.482 . . . . 72.33 110.827 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -92.14 -67.22 0.87 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 75.22 110.991 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.74 -135.32 6.36 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.729 -0.748 . . . . 73.12 112.477 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -145.62 95.23 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.841 0.353 . . . . 72.33 110.913 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.509 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.5 OUTLIER -59.67 104.91 0.32 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.221 -0.445 . . . . 75.52 110.889 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 8.8 p -145.9 133.04 14.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.43 . . . . 74.24 111.145 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -49.25 132.75 19.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.178 -0.464 . . . . 73.31 110.868 -179.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.426 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 178.09 77.58 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.752 -0.737 . . . . 74.04 112.483 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.426 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -35.65 143.8 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.91 0.386 . . . . 74.44 111.094 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.31 -168.15 2.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.132 -0.485 . . . . 73.34 110.912 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -93.27 116.08 28.66 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.22 -0.445 . . . . 75.12 110.88 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.454 ' O ' ' HA ' ' A' ' 28' ' ' VAL . 8.6 mm -107.68 91.35 7.24 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.654 0.74 . . . . 74.22 111.098 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.435 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.8 105.1 1.43 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.716 2.277 . . . . 72.51 112.306 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -70.69 -29.64 66.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.993 0.425 . . . . 75.53 110.932 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 24.3 m -130.74 146.36 52.19 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.114 -0.493 . . . . 63.33 111.231 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -140.17 48.23 1.78 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 73.4 110.908 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.16 -69.03 0.57 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 75.55 110.847 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -134.56 -40.45 0.17 Allowed Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.746 -0.74 . . . . 64.21 112.428 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.95 39.61 1.52 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.901 0.381 . . . . 74.34 110.897 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.1 tttt -49.33 109.65 0.29 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 73.32 110.86 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.2 t -128.08 92.27 3.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.275 -0.42 . . . . 73.42 111.127 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 0.8 OUTLIER -80.33 140.12 17.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 73.31 111.15 179.865 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.421 ' O ' HG12 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -86.53 63.34 7.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 73.25 110.955 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.9 mttp -41.46 105.56 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 75.42 110.858 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 115.5 62.1 0.37 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.653 -0.784 . . . . 73.35 112.398 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.421 HG12 ' O ' ' A' ' 29' ' ' LEU . 19.4 mm -118.31 92.3 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.852 0.358 . . . . 74.32 111.151 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.12 153.25 39.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 61.35 110.827 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 168.22 -109.63 0.35 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.751 -0.738 . . . . 62.31 112.497 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.509 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 61.4 mt -156.82 85.81 0.97 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.89 0.376 . . . . 73.12 110.892 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -158.75 163.35 36.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.161 -0.472 . . . . 74.34 110.895 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -168.38 -47.27 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.068 -0.515 . . . . 73.4 110.93 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.2 m -120.54 -47.05 2.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 75.2 111.186 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -87.45 169.42 12.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.167 -0.469 . . . . 71.53 110.849 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.4 m -136.84 15.15 3.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 74.13 110.892 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -103.79 -62.88 1.25 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.157 -0.474 . . . . 73.43 110.925 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -77.14 61.91 2.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 65.02 110.891 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.3 p -98.03 155.64 17.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.491 . . . . 74.12 110.923 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 21.0 mm -141.84 140.45 30.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.466 . . . . 74.12 111.135 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.8 mtt -144.53 134.79 24.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 73.43 110.884 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.3 m-20 -81.93 -169.85 2.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 64.13 110.851 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.06 -60.1 4.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 74.35 110.934 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -51.76 -57.44 9.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.275 -0.42 . . . . 75.02 110.899 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.42 -58.75 5.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 73.14 110.912 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.9 t -53.74 -38.88 64.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 73.11 110.821 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.75 -43.99 97.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.096 -0.502 . . . . 72.14 110.904 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.83 -58.34 6.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 74.22 111.069 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -54.42 -47.3 72.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.257 -0.429 . . . . 75.51 110.869 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.82 -50.44 68.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.131 -0.486 . . . . 72.25 110.857 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.5 -41.2 60.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 64.21 111.107 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.417 ' HB2' ' HG ' ' A' ' 29' ' ' LEU . 3.4 mt-30 -69.97 -66.99 0.52 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 74.14 110.946 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.1 m -47.82 -35.51 4.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 74.13 111.092 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -69.05 -54.43 15.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 73.22 110.87 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.62 -52.44 39.48 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 72.22 111.134 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.48 -44.69 90.23 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.449 . . . . 75.13 110.893 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.0 mtt-85 -50.7 -51.63 47.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.158 -0.473 . . . . 73.13 110.933 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.69 -54.14 36.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 75.13 111.044 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.62 -38.58 32.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 54.3 110.878 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 44.4 t -82.4 -25.99 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 72.52 111.121 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -22.98 67.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.159 -0.473 . . . . 74.43 110.867 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.48 -17.0 64.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 75.05 111.145 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -60.41 -20.2 58.81 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.125 -0.488 . . . . 75.41 110.901 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 92.8 m -158.51 -75.74 0.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 74.54 111.179 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 17.6 m -148.62 -172.77 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 73.32 111.136 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -103.14 153.73 38.15 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.541 0.686 . . . . 64.23 111.021 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.67 -7.69 21.68 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.685 2.257 . . . . 72.52 112.367 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -98.85 -36.31 9.83 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.201 -0.454 . . . . 71.53 110.852 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -57.76 -61.13 2.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.194 -0.457 . . . . 71.33 110.896 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.4 ' O ' ' HG3' ' A' ' 78' ' ' ARG . 0.3 OUTLIER -40.01 -70.47 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 74.21 111.17 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.7 m -48.85 -38.87 10.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.151 -0.477 . . . . 75.25 111.205 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.6 mtmt -62.77 -39.05 92.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 75.23 110.802 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 39.3 t -68.07 -38.07 79.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.268 -0.424 . . . . 74.5 111.121 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' A' ' 74' ' ' ILE . 0.7 OUTLIER -70.33 -36.51 74.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 72.44 110.851 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -84.08 -20.84 31.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.169 -0.469 . . . . 74.11 110.895 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.5 ttmt -75.59 -50.19 16.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 71.23 110.87 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 12.9 mt -90.19 12.22 18.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 75.3 110.918 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.3 t 52.47 40.8 30.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 64.43 110.851 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -79.13 84.61 5.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 74.32 110.864 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.29 156.33 0.11 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 70.51 111.131 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -58.33 -24.7 60.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 75.24 110.9 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -77.08 -49.01 16.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 75.15 110.945 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.98 -54.83 13.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.226 -0.443 . . . . 72.55 110.919 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.69 -35.35 42.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 73.15 111.104 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.2 m -78.67 -37.07 42.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 64.13 110.892 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -72.76 -24.79 61.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.128 -0.487 . . . . 73.53 110.82 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 51.9 mt -101.47 -64.09 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 75.43 111.112 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -71.72 -61.26 1.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 75.43 110.975 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.65 45.01 1.0 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.796 -0.716 . . . . 63.14 112.458 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -66.59 -46.62 74.9 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.751 -0.738 . . . . 41.52 112.564 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.49 172.54 21.45 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.717 -0.754 . . . . 74.32 112.5 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -50.9 -66.64 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.869 0.366 . . . . 63.43 111.099 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -86.24 42.23 0.98 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.155 -0.475 . . . . 71.14 110.882 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.13 -76.18 0.06 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 74.33 111.145 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -39.66 -40.32 0.89 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 75.24 110.866 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.9 m -59.93 -76.28 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.163 -0.471 . . . . 74.31 110.89 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 24.6 mtt85 -49.93 -45.66 51.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.102 -0.499 . . . . 75.44 110.885 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -56.96 -36.57 70.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 73.52 110.943 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 -59.81 -25.98 65.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.104 -0.498 . . . . 74.53 110.891 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.11 -20.5 14.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 74.44 110.903 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.15 28.38 11.9 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.742 -0.742 . . . . 73.05 112.564 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 60.1 m-20 -104.35 -8.65 19.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.819 0.342 . . . . 71.42 110.926 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -114.52 15.14 17.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 43.5 111.12 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.473 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -127.04 54.6 12.63 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.529 0.68 . . . . 71.15 110.904 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.479 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.0 Cg_endo -69.75 37.03 0.24 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.642 2.228 . . . . 75.43 112.347 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.748 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.5 t-160 71.9 34.06 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.65 0.738 . . . . 74.34 110.856 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.748 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.4 Cg_endo -69.77 -164.07 0.12 Allowed 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.665 2.243 . . . . 74.13 112.412 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.94 -32.77 30.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.311 -0.404 . . . . 63.14 110.874 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 21.0 m -52.3 -55.35 21.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.476 . . . . 73.42 111.176 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 42.7 mm -50.94 -46.55 30.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 75.11 111.116 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -28.53 69.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 73.22 110.894 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 5.8 mp -81.29 -47.5 13.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.265 -0.425 . . . . 74.04 110.922 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.406 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 21.5 mt -55.91 -47.75 76.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.47 . . . . 73.2 110.995 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -54.91 -35.6 64.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 72.2 110.915 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 31.7 m -95.7 -3.46 10.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 74.33 111.145 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.406 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.4 OUTLIER -89.68 -40.73 12.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 72.21 110.909 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -49.31 -32.43 11.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.256 -0.429 . . . . 72.41 110.849 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.47 -20.53 18.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 74.04 110.856 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 48.0 m-70 -127.36 87.34 56.53 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.602 0.715 . . . . 63.5 110.865 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.73 3.9 2.49 Favored 'Trans proline' 0 C--N 1.341 0.14 0 C-N-CA 122.747 2.298 . . . . 63.34 112.338 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -117.91 -12.42 10.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 74.54 110.897 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.7 tp -53.6 -48.09 69.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 73.41 110.958 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -46.33 -32.75 3.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 64.0 110.922 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -81.96 -38.08 25.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 73.41 110.927 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.72 -5.72 53.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.479 . . . . 74.2 110.892 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 8.7 pt -118.14 -22.26 4.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.152 -0.476 . . . . 75.14 111.133 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.193 -0.458 . . . . 73.22 110.889 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mtt . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.838 0.352 . . . . 71.03 110.879 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.24 -171.21 0.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.192 -0.458 . . . . 75.44 110.906 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.403 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 0.5 OUTLIER 175.79 56.72 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.651 0.739 . . . . 74.45 110.96 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 53.3 Cg_endo -69.73 2.39 3.56 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.724 2.282 . . . . 74.04 112.327 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.89 -44.6 11.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.448 . . . . 73.21 111.144 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 7' ' ' HIS . 0.1 OUTLIER -112.2 -40.01 4.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.169 -0.469 . . . . 74.21 110.894 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.414 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 24.6 m-70 69.29 51.63 0.5 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 72.33 110.854 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -120.31 -71.95 0.71 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 75.22 110.949 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -99.61 -121.38 4.6 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.669 -0.776 . . . . 73.12 112.556 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -169.29 87.52 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.804 0.335 . . . . 72.33 110.938 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.488 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -46.04 105.71 0.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 75.52 110.869 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.9 p -144.57 129.2 13.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 74.24 111.148 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.6 p -47.5 126.23 9.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 73.31 110.89 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.88 80.99 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.692 -0.766 . . . . 74.04 112.429 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -37.27 147.24 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.88 0.371 . . . . 74.44 111.097 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.32 -165.32 1.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 73.34 110.899 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -96.54 117.34 30.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.262 -0.426 . . . . 75.12 110.851 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.7 mm -108.05 91.3 7.68 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.639 0.733 . . . . 74.22 111.146 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.7 96.26 0.58 Allowed 'Trans proline' 0 N--CA 1.464 -0.217 0 C-N-CA 122.754 2.302 . . . . 72.51 112.38 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -64.29 -34.61 78.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 75.53 110.926 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.412 HG23 ' HG2' ' A' ' 25' ' ' ARG . 17.5 m -130.29 146.89 51.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 63.33 111.155 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -144.63 43.49 1.37 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 73.4 110.917 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.28 -39.64 1.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 75.55 110.802 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -160.48 -53.23 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.736 -0.745 . . . . 64.21 112.495 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.412 ' HG2' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.75 42.44 1.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.867 0.365 . . . . 74.34 110.925 -179.897 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 15.1 tttm -49.77 117.47 2.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 73.32 110.893 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 t -128.91 91.04 3.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 73.42 111.08 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 43.0 t -76.62 126.7 37.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.232 -0.44 . . . . 73.31 111.132 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.77 51.78 2.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 73.25 110.913 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -38.59 107.47 0.07 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 75.42 110.922 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.24 46.09 0.38 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.755 -0.736 . . . . 73.35 112.5 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 13.4 mm -107.37 89.98 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.923 0.392 . . . . 74.32 111.146 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.33 156.43 38.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 61.35 110.875 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.13 -107.39 0.28 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.721 -0.752 . . . . 62.31 112.456 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.488 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 55.6 mt -156.27 82.47 0.99 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.896 0.379 . . . . 73.12 110.87 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -164.88 166.23 19.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.46 . . . . 74.34 110.91 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.5 -34.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 73.4 110.85 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.3 m -121.34 -45.28 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 75.2 111.087 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -98.94 176.02 5.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 71.53 110.856 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.5 p -141.25 28.81 1.84 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.205 -0.452 . . . . 74.13 110.85 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -110.49 -65.68 1.14 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.173 -0.467 . . . . 73.43 110.922 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -76.56 62.29 1.9 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 65.02 110.937 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.1 p -93.05 138.62 31.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 74.12 110.874 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 13.3 mm -135.71 138.91 47.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.086 -0.507 . . . . 74.12 111.115 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 15.2 mtt -139.3 143.19 37.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 73.43 110.854 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.6 m-20 -90.82 -168.91 2.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 64.13 110.844 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.17 -60.41 3.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.131 -0.486 . . . . 74.35 110.996 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.92 -58.24 7.61 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.139 -0.482 . . . . 75.02 110.9 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -50.5 -59.35 4.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 73.14 110.915 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.0 t -52.45 -42.91 64.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 73.11 110.78 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -57.38 -43.38 83.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.152 -0.476 . . . . 72.14 110.842 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.45 -61.93 1.82 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 74.22 111.113 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -52.56 -45.84 66.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.179 -0.464 . . . . 75.51 110.887 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.2 -50.41 68.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 72.25 110.842 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.21 -41.73 60.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.303 -0.408 . . . . 64.21 111.153 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -70.64 -66.99 0.53 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 74.14 110.93 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.3 m -47.03 -35.64 3.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.257 -0.429 . . . . 74.13 111.094 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 11.0 mmmm -70.31 -51.91 26.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 73.22 110.939 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.4 -52.32 46.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.47 . . . . 72.22 111.14 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -65.29 -46.24 81.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 75.13 110.883 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -49.88 -52.49 32.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.104 -0.498 . . . . 73.13 110.866 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.82 -54.54 33.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 75.13 111.094 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.69 -42.05 33.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 54.3 110.836 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 42.9 t -77.15 -28.49 16.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.164 -0.471 . . . . 72.52 111.142 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -20.62 59.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 74.43 110.853 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.69 -23.04 58.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 75.05 111.093 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -56.96 -75.18 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 75.41 110.933 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 93.6 m -149.39 -75.96 0.16 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 74.54 111.102 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 17.0 m -149.59 -172.56 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.229 -0.441 . . . . 73.32 111.049 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -104.92 158.17 32.61 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.547 0.689 . . . . 64.23 111.075 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 -8.15 22.88 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.604 2.202 . . . . 72.52 112.42 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -97.81 -34.87 10.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 71.53 110.797 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -57.5 -61.12 2.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.454 . . . . 71.33 110.9 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -44.82 -68.04 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 74.21 111.104 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -48.66 -38.88 10.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 75.25 111.177 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.8 mtmt -61.14 -45.5 94.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.456 . . . . 75.23 110.935 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.5 t -62.03 -39.48 83.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 74.5 111.112 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -58.65 6.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 72.44 110.854 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -24.1 67.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 74.11 110.979 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.2 ttmt -67.97 -53.67 24.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 71.23 110.879 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 10.9 mt -90.68 12.79 17.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.192 -0.458 . . . . 75.3 110.947 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.3 t 53.5 38.41 28.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.117 -0.492 . . . . 64.43 110.915 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -79.58 87.04 5.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.127 -0.488 . . . . 74.32 110.943 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.55 157.4 0.1 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 70.51 111.115 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -57.55 -21.49 38.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 75.24 110.921 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -81.16 -49.21 11.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 75.15 110.957 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -62.47 -54.31 42.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.448 . . . . 72.55 110.863 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.72 -35.8 64.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.483 . . . . 73.15 111.083 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 91.5 p -79.68 -26.11 41.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 64.13 110.832 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.93 -25.88 34.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.469 . . . . 73.53 110.873 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 24.5 mm -103.35 -59.05 3.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.157 -0.474 . . . . 75.43 111.17 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -75.77 -60.96 2.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 75.43 110.87 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.3 49.44 0.76 Allowed Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.711 -0.756 . . . . 63.14 112.527 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.79 -37.39 34.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 41.52 112.509 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 102.11 165.71 26.8 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.685 -0.769 . . . . 74.32 112.467 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.9 p -51.4 -50.67 27.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.832 0.348 . . . . 63.43 111.15 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -86.93 37.73 0.77 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 71.14 110.928 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.46 -76.43 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 74.33 111.11 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -43.25 -39.97 3.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 75.24 110.893 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.37 -75.38 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 74.31 110.876 -179.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 44.6 mtt180 -49.92 -45.02 50.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.075 -0.512 . . . . 75.44 110.892 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -56.35 -37.54 70.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 73.52 110.909 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -53.35 -27.43 23.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.075 -0.511 . . . . 74.53 110.892 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.56 -22.2 12.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 74.44 110.9 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.23 28.16 9.43 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.77 -0.729 . . . . 73.05 112.48 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 65.3 m-20 -100.36 -6.87 25.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.362 . . . . 71.42 110.915 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -109.74 10.68 24.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.189 -0.46 . . . . 43.5 111.101 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.492 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -125.61 56.96 16.11 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.585 0.707 . . . . 71.15 110.96 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.507 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.8 Cg_endo -69.75 36.38 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.698 2.265 . . . . 75.43 112.317 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.773 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.6 t60 73.89 32.33 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.646 0.736 . . . . 74.34 110.865 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.773 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 52.9 Cg_endo -69.8 -163.98 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.721 2.281 . . . . 74.13 112.301 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.0 p -86.94 -28.95 22.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.235 -0.439 . . . . 63.14 110.87 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 22.0 m -53.5 -51.38 62.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.162 -0.472 . . . . 73.42 111.17 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 38.9 mm -51.26 -42.52 26.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 75.11 111.105 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.44 -29.92 69.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.154 -0.475 . . . . 73.22 110.915 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.7 mp -79.23 -41.72 27.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.456 . . . . 74.04 110.922 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.461 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 13.8 mt -63.66 -49.51 72.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 73.2 110.902 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 14.5 ptp180 -52.07 -35.7 48.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 72.2 110.882 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 31.0 m -92.57 -14.07 8.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 74.33 111.099 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.5 OUTLIER -77.04 -39.64 49.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.268 -0.424 . . . . 72.21 110.874 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -50.44 -31.44 15.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.174 -0.466 . . . . 72.41 110.871 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -95.8 -19.86 19.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 74.04 110.966 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -131.41 90.07 38.92 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.589 0.709 . . . . 63.5 110.801 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.71 0.13 6.05 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.745 2.297 . . . . 63.34 112.324 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -113.8 -11.95 12.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 74.54 110.882 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 6.3 tp -53.6 -47.84 69.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.118 -0.492 . . . . 73.41 110.96 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.429 ' HA ' HG12 ' A' ' 130' ' ' ILE . 2.2 pt? -51.1 -29.0 11.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.12 -0.491 . . . . 64.0 110.968 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.465 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.67 -26.07 24.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.174 -0.466 . . . . 73.41 110.906 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -95.88 3.31 53.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 74.2 110.917 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.429 HG12 ' HA ' ' A' ' 127' ' ' LEU . 12.8 pt -122.25 -34.52 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 75.14 111.093 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.465 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.3 ptt-85 . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 73.22 110.84 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mtt . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.884 0.374 . . . . 71.03 110.835 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.63 -169.53 0.43 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.429 . . . . 75.44 110.891 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.5 p 176.88 57.17 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.623 0.725 . . . . 74.45 110.875 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.79 0.52 5.55 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.715 2.277 . . . . 74.04 112.302 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 2.9 m -91.99 -40.37 12.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 73.21 111.2 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 7' ' ' HIS . 0.0 OUTLIER -122.9 -36.33 2.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 74.21 110.858 179.981 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.413 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 24.0 m-70 70.49 61.84 0.21 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 72.33 110.844 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -127.8 -77.15 0.57 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 75.22 110.96 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.404 ' HA3' ' HB3' ' A' ' 39' ' ' HIS . . . -94.43 -118.02 2.98 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.785 -0.722 . . . . 73.12 112.478 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -177.45 96.57 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.905 0.383 . . . . 72.33 110.935 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.432 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -48.36 103.74 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 75.52 110.89 -179.974 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.1 p -141.71 125.11 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 74.24 111.117 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 p -46.66 128.55 10.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.256 -0.429 . . . . 73.31 110.909 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.423 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . -179.7 79.94 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.722 -0.751 . . . . 74.04 112.47 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.423 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.42 146.16 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.905 0.383 . . . . 74.44 111.151 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.8 -166.3 1.96 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 73.34 110.906 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -94.63 119.73 33.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 75.12 110.825 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.3 mm -110.78 92.15 13.97 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.596 0.713 . . . . 74.22 111.181 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.67 94.87 0.53 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.696 2.264 . . . . 72.51 112.369 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -60.75 -39.02 87.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 75.53 110.961 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.3 m -130.67 145.12 51.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.072 -0.513 . . . . 63.33 111.153 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 16.4 p90 -136.12 47.49 2.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.231 -0.44 . . . . 73.4 110.938 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.51 -68.58 0.57 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 75.55 110.89 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.07 -44.88 0.1 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.746 -0.74 . . . . 64.21 112.494 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.79 40.37 1.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.907 0.384 . . . . 74.34 110.92 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -53.92 124.22 14.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 73.32 110.9 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 t -139.2 94.46 2.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.142 -0.481 . . . . 73.42 111.131 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 45.1 t -76.8 127.4 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 73.31 111.151 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.4 ' O ' ' C ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -84.86 51.57 2.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.172 -0.467 . . . . 73.25 110.916 179.956 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 29' ' ' LEU . 22.0 mttp -38.46 107.22 0.06 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 75.42 110.888 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.52 45.51 0.39 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.767 -0.73 . . . . 73.35 112.487 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 15.2 mm -106.3 91.38 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.854 0.359 . . . . 74.32 111.097 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.0 156.87 37.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 61.35 110.827 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.22 -106.89 0.28 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.79 -0.719 . . . . 62.31 112.518 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.432 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 50.3 mt -156.17 83.35 1.0 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.88 0.372 . . . . 73.12 110.845 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.434 ' CD1' ' N ' ' A' ' 36' ' ' TYR . 0.1 OUTLIER -167.97 161.69 12.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.489 . . . . 74.34 110.909 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.35 -33.61 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.161 -0.472 . . . . 73.4 110.886 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.5 p -118.93 -24.7 3.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 75.2 111.128 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.404 ' HB3' ' HA3' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -126.17 177.96 6.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.166 -0.47 . . . . 71.53 110.809 179.978 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.8 p -138.92 9.95 2.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 74.13 110.885 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -92.98 -66.04 0.95 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 73.43 110.901 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -75.71 60.92 1.33 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.49 . . . . 65.02 110.87 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.9 p -94.19 149.54 21.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.15 -0.477 . . . . 74.12 110.88 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 16.5 mm -144.1 137.95 24.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.481 . . . . 74.12 111.156 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.7 mtt -139.65 143.58 37.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.246 -0.434 . . . . 73.43 110.863 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -97.14 -168.55 1.72 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 64.13 110.853 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.48 -56.32 19.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.116 -0.493 . . . . 74.35 110.926 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -57.0 -58.3 8.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 75.02 110.928 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.68 -60.29 3.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.133 -0.485 . . . . 73.14 110.891 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.2 t -53.37 -39.41 64.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 73.11 110.856 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.69 -45.83 88.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.088 -0.505 . . . . 72.14 110.863 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.86 -59.16 4.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 74.22 111.089 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -53.3 -48.23 68.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.17 -0.468 . . . . 75.51 110.858 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -48.72 77.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 72.25 110.914 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.5 -40.49 62.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 64.21 111.072 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -71.09 -66.63 0.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.147 -0.478 . . . . 74.14 110.884 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.2 m -47.6 -35.16 4.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.171 -0.468 . . . . 74.13 111.096 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -71.19 -52.04 21.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 73.22 110.918 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.47 -49.0 62.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.449 . . . . 72.22 111.129 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -67.0 -48.09 69.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 75.13 110.946 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -49.67 -48.96 49.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 73.13 110.881 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.36 -55.88 13.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.491 . . . . 75.13 111.125 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.54 -40.88 39.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.21 -0.45 . . . . 54.3 110.84 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 36.4 t -80.27 -25.28 11.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 72.52 111.15 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -21.24 66.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 74.43 110.901 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.91 -13.73 60.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 75.05 111.094 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -69.51 -12.0 61.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 75.41 110.829 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 43.3 m -127.35 -76.6 0.57 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 74.54 111.131 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -147.76 141.55 19.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.171 -0.468 . . . . 73.32 111.081 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -81.76 161.14 62.18 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.552 0.691 . . . . 64.23 111.071 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -6.98 19.89 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.706 2.271 . . . . 72.52 112.311 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -99.82 -37.8 8.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 71.53 110.89 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -57.04 -62.17 1.94 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.143 -0.48 . . . . 71.33 110.879 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -43.73 -68.09 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 74.21 111.102 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.5 m -49.08 -39.1 11.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.111 -0.495 . . . . 75.25 111.092 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -61.42 -37.77 84.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 75.23 110.825 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 97.2 t -70.67 -38.39 72.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.274 -0.421 . . . . 74.5 111.127 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.9 OUTLIER -69.83 -33.22 72.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 72.44 110.899 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -89.75 -19.17 25.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 74.11 110.886 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.2 ttmm -75.85 -51.62 12.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.265 -0.425 . . . . 71.23 110.861 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.3 mt -91.49 14.47 14.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.245 -0.434 . . . . 75.3 110.922 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.02 43.19 29.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.439 . . . . 64.43 110.915 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -79.18 86.07 5.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.099 -0.5 . . . . 74.32 110.925 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -46.85 155.8 0.24 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 70.51 111.14 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.61 -22.24 61.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 75.24 110.991 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -77.34 -54.25 6.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 75.15 110.949 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.5 -51.75 57.77 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.181 -0.463 . . . . 72.55 110.969 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.91 -32.68 54.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 73.15 111.021 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 13.7 t -80.34 -35.8 35.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 64.13 110.842 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -75.77 -21.13 57.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.088 -0.506 . . . . 73.53 110.896 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 55.7 mt -104.93 -62.35 2.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 75.43 111.112 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -75.31 -61.58 1.85 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 75.43 110.921 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 113.17 48.16 0.62 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.723 -0.751 . . . . 63.14 112.422 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -69.78 -41.06 74.95 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.732 -0.747 . . . . 41.52 112.436 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 100.87 -155.85 19.27 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.76 -0.733 . . . . 74.32 112.533 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.5 t -80.56 -70.25 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 63.43 111.161 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -84.9 41.24 0.85 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.112 -0.494 . . . . 71.14 110.913 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.61 -73.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 74.33 111.041 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -40.36 -41.68 1.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 75.24 110.871 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -60.1 -75.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 74.31 110.893 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -48.5 -47.9 38.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 75.44 110.886 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -55.02 -37.78 67.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 73.52 110.943 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -53.3 -31.84 45.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 74.53 110.919 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.84 -20.5 14.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.116 -0.493 . . . . 74.44 110.909 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.63 25.41 13.58 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.731 -0.747 . . . . 73.05 112.541 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -98.38 -5.31 32.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.884 0.373 . . . . 71.42 110.909 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -118.02 17.17 14.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 43.5 111.093 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.457 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -126.32 54.01 10.37 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.572 0.701 . . . . 71.15 110.948 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.481 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.2 Cg_endo -69.66 39.79 0.28 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.705 2.27 . . . . 75.43 112.34 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.736 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.3 m170 71.0 35.51 0.09 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.546 0.689 . . . . 74.34 110.898 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.736 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.2 Cg_endo -69.75 -164.05 0.12 Allowed 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.641 2.228 . . . . 74.13 112.353 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.5 m -89.17 -23.84 22.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 63.14 110.831 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 21.1 m -61.49 -45.95 92.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.114 -0.494 . . . . 73.42 111.139 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 44.0 mm -56.35 -43.38 77.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 75.11 111.064 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -33.75 73.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.142 -0.481 . . . . 73.22 110.873 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.416 ' O ' ' HB2' ' A' ' 120' ' ' LEU . 7.5 mp -74.39 -38.12 63.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.235 -0.438 . . . . 74.04 110.918 179.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.412 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 33.7 mt -68.46 -51.42 43.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 73.2 110.974 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -50.33 -34.46 23.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 72.2 110.864 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 21.7 m -91.75 -19.98 6.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.224 -0.443 . . . . 74.33 111.085 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 116' ' ' LEU . 0.4 OUTLIER -72.78 -44.58 61.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.171 -0.468 . . . . 72.21 110.92 179.963 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -48.54 -29.45 4.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 72.41 110.794 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -91.78 -30.16 16.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.465 . . . . 74.04 110.894 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -128.06 98.37 27.2 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.552 0.692 . . . . 63.5 110.857 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 3.93 2.51 Favored 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.652 2.235 . . . . 63.34 112.357 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -115.2 -12.58 11.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.257 -0.429 . . . . 74.54 110.878 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.1 mt -50.42 -48.53 56.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 73.41 110.924 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' A' ' 131' ' ' ARG . 1.7 pt? -49.67 -29.47 7.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 64.0 110.978 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.452 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.3 m-80 -86.85 -26.9 23.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 73.41 110.902 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -96.89 7.81 45.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 74.2 110.885 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 7.8 pt -128.06 -34.32 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 75.14 111.103 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.452 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 0.9 OUTLIER . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.253 -0.431 . . . . 73.22 110.858 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mmt . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.893 0.378 . . . . 71.03 110.883 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.66 -169.2 0.41 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 75.44 110.893 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.1 p 177.64 58.39 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.641 0.734 . . . . 74.45 110.844 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 1.94 3.95 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.71 2.274 . . . . 74.04 112.348 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 23.8 m -92.78 -37.28 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 73.21 111.184 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -127.26 -33.46 2.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.155 -0.475 . . . . 74.21 110.88 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 66.4 57.67 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 72.33 110.806 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 93.4 mm-40 -121.3 -75.92 0.59 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.224 -0.444 . . . . 75.22 110.914 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -99.09 -114.74 3.55 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.682 -0.771 . . . . 73.12 112.477 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -174.3 98.07 0.1 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.803 0.335 . . . . 72.33 110.866 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.533 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -59.63 107.4 0.59 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.201 -0.454 . . . . 75.52 110.824 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 6.6 p -146.7 127.44 6.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 74.24 111.157 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.8 p -48.61 135.81 14.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.449 . . . . 73.31 110.86 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.435 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 174.41 77.29 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.784 -0.722 . . . . 74.04 112.531 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.435 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.7 OUTLIER -33.71 141.35 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.897 0.379 . . . . 74.44 111.102 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.17 -168.14 2.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.441 . . . . 73.34 110.939 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -93.2 116.25 28.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.271 -0.422 . . . . 75.12 110.913 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.442 ' O ' ' HA ' ' A' ' 28' ' ' VAL . 8.6 mm -107.91 91.27 7.44 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.653 0.739 . . . . 74.22 111.058 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.427 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 54.4 Cg_endo -69.71 103.85 1.22 Allowed 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.688 2.258 . . . . 72.51 112.379 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -68.72 -34.2 75.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 75.53 110.926 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.5 m -128.05 147.37 50.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.107 -0.497 . . . . 63.33 111.077 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -141.62 47.78 1.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 73.4 110.91 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.18 -68.7 0.55 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.116 -0.493 . . . . 75.55 110.863 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -132.32 -42.92 0.17 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.708 -0.758 . . . . 64.21 112.404 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.05 40.46 1.33 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.842 0.353 . . . . 74.34 110.87 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -50.08 113.9 0.97 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 73.32 110.91 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.1 t -134.65 94.76 3.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 73.42 111.151 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.442 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 0.8 OUTLIER -82.15 140.29 16.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 73.31 111.122 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.43 ' HG ' ' HB2' ' A' ' 56' ' ' GLN . 0.2 OUTLIER -86.46 63.32 7.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 73.25 110.983 179.929 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -41.6 105.22 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 75.42 110.852 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 115.37 62.46 0.37 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.737 -0.744 . . . . 73.35 112.516 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 29' ' ' LEU . 19.9 mm -118.05 93.3 2.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.827 0.346 . . . . 74.32 111.147 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.81 152.3 38.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 61.35 110.907 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.58 -109.42 0.34 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.689 -0.767 . . . . 62.31 112.46 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.533 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 51.6 mt -156.76 86.31 0.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.805 0.336 . . . . 73.12 110.881 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -160.77 159.85 30.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 74.34 110.922 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 32.3 t -164.05 -46.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.088 -0.505 . . . . 73.4 110.92 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.0 m -120.37 -47.05 2.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.198 -0.455 . . . . 75.2 111.105 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -87.96 171.45 10.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 71.53 110.811 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -137.64 9.99 2.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.218 -0.446 . . . . 74.13 110.878 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -99.24 -62.73 1.2 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 73.43 110.89 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -76.95 61.56 1.97 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 65.02 110.866 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.1 p -99.54 158.94 15.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 74.12 110.835 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 22.8 mm -140.95 139.75 33.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.153 -0.476 . . . . 74.12 111.17 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.7 mtm -145.87 131.82 19.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 73.43 110.902 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 44.0 m-20 -84.06 -169.78 2.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 64.13 110.857 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.19 -58.24 8.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 74.35 110.873 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.1 -55.8 24.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.191 -0.459 . . . . 75.02 110.867 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.47 -58.97 4.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 73.14 110.87 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.3 t -55.42 -38.41 68.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.15 -0.477 . . . . 73.11 110.826 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.09 -45.81 89.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 72.14 110.821 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.3 -58.12 6.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 74.22 111.159 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -54.02 -46.88 71.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 75.51 110.892 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.67 -50.52 66.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.125 -0.489 . . . . 72.25 110.883 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.39 -39.63 57.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.255 -0.43 . . . . 64.21 111.128 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.43 ' HB2' ' HG ' ' A' ' 29' ' ' LEU . 3.4 mt-30 -71.94 -67.56 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.248 -0.433 . . . . 74.14 110.847 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.9 m -46.77 -41.88 5.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 74.13 111.148 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.0 mmmm -65.94 -50.83 62.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.246 -0.433 . . . . 73.22 110.89 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.43 -52.28 39.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 72.22 111.128 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.45 -42.67 87.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 75.13 110.869 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 31.4 mtp85 -50.09 -52.98 30.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.154 -0.475 . . . . 73.13 110.892 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.26 -53.79 32.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 75.13 111.138 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.0 -39.48 26.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.293 -0.412 . . . . 54.3 110.813 -179.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 60.3 t -80.7 -28.13 11.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 72.52 111.088 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -19.58 48.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 74.43 110.877 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.35 -23.35 36.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.191 -0.459 . . . . 75.05 111.099 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -51.78 -74.85 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 75.41 110.871 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 92.9 m -118.52 -75.63 0.58 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 74.54 111.154 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 16.5 m -149.2 -172.37 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 73.32 111.128 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -105.57 159.75 28.43 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.653 0.74 . . . . 64.23 111.162 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 -8.12 22.8 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.699 2.266 . . . . 72.52 112.356 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -97.69 -35.33 10.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 71.53 110.853 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -57.43 -60.02 4.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 71.33 110.874 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -45.74 -68.41 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.18 -0.463 . . . . 74.21 111.124 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -48.2 -39.51 9.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.435 . . . . 75.25 111.166 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -60.18 -47.51 85.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.438 . . . . 75.23 110.875 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.0 t -60.49 -38.82 79.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 74.5 111.168 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.66 -60.05 3.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 72.44 110.939 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.31 -21.22 66.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.475 . . . . 74.11 110.899 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -70.32 -54.2 13.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.267 -0.424 . . . . 71.23 110.918 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.1 mt -91.29 14.84 13.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 75.3 110.931 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 30.5 m 53.89 37.52 26.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.159 -0.473 . . . . 64.43 110.869 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -79.69 83.82 5.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 74.32 110.912 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.19 157.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 70.51 111.137 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -56.45 -23.13 36.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.219 -0.446 . . . . 75.24 110.885 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.63 -48.54 13.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 75.15 110.916 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -61.63 -55.72 27.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.218 -0.447 . . . . 72.55 110.892 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.15 -32.45 10.1 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.184 -0.462 . . . . 73.15 111.087 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 5.6 p -80.54 -35.19 34.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 64.13 110.86 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -73.09 -23.7 60.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.084 -0.507 . . . . 73.53 110.846 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 19.3 mm -105.19 -63.02 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 75.43 111.09 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -74.62 -64.36 1.05 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.228 -0.442 . . . . 75.43 110.911 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 116.78 47.56 0.48 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.706 -0.759 . . . . 63.14 112.459 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -67.42 -35.34 87.01 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.768 -0.73 . . . . 41.52 112.443 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.31 -119.4 5.67 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.756 -0.735 . . . . 74.32 112.541 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.404 HG12 ' H ' ' A' ' 97' ' ' ASN . 0.1 OUTLIER -120.46 -61.57 2.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.859 0.362 . . . . 63.43 111.056 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.404 ' H ' HG12 ' A' ' 96' ' ' VAL . 1.0 OUTLIER -86.15 43.97 1.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.198 -0.455 . . . . 71.14 110.912 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.29 -75.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.144 -0.48 . . . . 74.33 111.125 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -41.81 -39.88 1.89 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 75.24 110.837 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.2 m -59.95 -76.22 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.116 -0.493 . . . . 74.31 110.836 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 -50.34 -44.66 54.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 75.44 110.884 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -55.86 -37.21 68.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 73.52 110.937 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -51.8 -29.26 18.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.1 -0.5 . . . . 74.53 110.867 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -107.16 -22.25 12.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 74.44 110.922 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.39 27.0 9.53 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.664 -0.779 . . . . 73.05 112.462 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 -98.34 -6.64 30.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.842 0.353 . . . . 71.42 110.843 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -110.51 10.57 23.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 43.5 111.123 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.491 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -124.19 57.2 13.02 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.579 0.704 . . . . 71.15 110.91 -179.895 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.496 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.9 Cg_endo -69.74 35.87 0.22 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.635 2.223 . . . . 75.43 112.408 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.762 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER 73.67 32.56 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.634 0.731 . . . . 74.34 110.894 179.934 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.762 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.0 Cg_endo -69.72 -164.02 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.721 2.28 . . . . 74.13 112.351 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.32 -30.95 21.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.473 . . . . 63.14 110.852 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 74.7 m -53.48 -48.08 69.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 73.42 111.101 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 40.2 mm -55.19 -46.27 77.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.45 . . . . 75.11 111.189 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.39 -29.14 70.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.149 -0.478 . . . . 73.22 110.894 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.4 mp -79.69 -42.45 24.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.203 -0.453 . . . . 74.04 110.862 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.425 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 3.8 mt -61.19 -49.71 76.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.451 . . . . 73.2 110.863 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -52.85 -37.22 59.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 72.2 110.859 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 32.8 m -90.87 -11.35 9.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.222 -0.445 . . . . 74.33 111.108 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.425 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.5 OUTLIER -81.71 -40.23 23.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 72.21 110.912 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -50.44 -30.23 12.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 72.41 110.872 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -98.09 -19.26 18.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 74.04 110.876 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 57.1 m-70 -129.64 88.89 48.35 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.607 0.718 . . . . 63.5 110.917 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 2.17 3.77 Favored 'Trans proline' 0 N--CA 1.466 -0.13 0 C-N-CA 122.68 2.253 . . . . 63.34 112.351 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -115.75 -12.59 11.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 74.54 110.872 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.7 tp -54.26 -46.46 72.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 73.41 110.892 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' A' ' 131' ' ' ARG . 0.9 OUTLIER -48.61 -30.62 5.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.165 -0.47 . . . . 64.0 110.896 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.433 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.2 m-80 -85.19 -31.06 23.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 73.41 110.889 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -89.75 4.41 49.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 74.2 110.86 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 12.8 pt -123.63 -34.84 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.477 . . . . 75.14 111.157 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.433 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 73.22 110.873 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.85 0.357 . . . . 71.03 110.895 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.43 -169.71 0.46 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.261 -0.427 . . . . 75.44 110.871 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.417 ' O ' ' N ' ' A' ' 7' ' ' HIS . 1.9 p 176.7 59.42 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.61 0.719 . . . . 74.45 110.937 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.7 1.74 4.13 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.664 2.242 . . . . 74.04 112.371 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.8 m -92.93 -37.35 8.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 73.21 111.148 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -127.0 -33.52 2.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 74.21 110.878 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.417 ' N ' ' O ' ' A' ' 3' ' ' CYS . 15.9 m-70 66.6 57.56 0.68 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.23 -0.441 . . . . 72.33 110.84 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -123.49 -75.78 0.6 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.278 -0.419 . . . . 75.22 110.869 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.56 -116.05 3.02 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.783 -0.722 . . . . 73.12 112.484 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -176.65 94.82 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.768 0.318 . . . . 72.33 110.929 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.567 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.3 ptp -54.62 106.19 0.2 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 75.52 110.809 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.2 p -143.27 124.44 10.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 74.24 111.128 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 p -48.75 132.05 17.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 73.31 110.897 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.409 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.98 81.93 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.763 -0.732 . . . . 74.04 112.516 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.409 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.88 146.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.848 0.356 . . . . 74.44 111.154 -179.933 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.86 -165.51 1.65 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.183 -0.462 . . . . 73.34 110.94 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.19 116.76 29.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 75.12 110.871 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.1 mm -107.52 92.89 9.07 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.687 0.756 . . . . 74.22 111.112 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 97.1 0.63 Allowed 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.651 2.234 . . . . 72.51 112.343 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -62.94 -38.54 91.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 75.53 110.899 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.0 m -128.91 144.53 51.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 63.33 111.167 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -133.89 43.43 2.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.282 -0.417 . . . . 73.4 110.916 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.28 -68.38 0.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.154 -0.476 . . . . 75.55 110.884 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -136.53 -46.04 0.08 OUTLIER Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.674 -0.774 . . . . 64.21 112.47 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.32 39.77 1.09 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.857 0.361 . . . . 74.34 110.885 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -52.32 115.42 1.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 73.32 110.931 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 t -129.06 93.32 3.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.261 -0.427 . . . . 73.42 111.13 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 46.4 t -76.63 127.53 37.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.449 . . . . 73.31 111.117 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.71 51.22 2.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 73.25 110.95 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.2 mttp -37.74 107.64 0.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 75.42 110.88 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.67 47.46 0.4 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.791 -0.718 . . . . 73.35 112.497 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 16.7 mm -107.93 92.12 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.799 0.333 . . . . 74.32 111.2 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.05 154.07 38.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.456 . . . . 61.35 110.868 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.25 -107.8 0.29 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.708 -0.758 . . . . 62.31 112.493 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.567 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 45.1 mt -156.99 87.23 0.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.743 0.306 . . . . 73.12 110.856 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -162.62 159.47 24.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.195 -0.457 . . . . 74.34 110.929 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 36.1 t -168.56 -38.86 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.078 -0.51 . . . . 73.4 110.881 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.5 p -124.05 -47.02 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 75.2 111.146 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -91.1 171.76 9.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 71.53 110.891 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.8 p -137.3 9.58 2.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 74.13 110.831 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -100.38 -62.67 1.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 73.43 110.926 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -76.73 61.68 1.89 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 65.02 110.865 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.4 p -99.08 159.5 14.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 74.12 110.881 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 21.3 mm -143.85 140.06 25.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 74.12 111.121 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.7 mtt -143.27 135.11 26.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.439 . . . . 73.43 110.859 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -86.89 -169.5 2.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.187 -0.46 . . . . 64.13 110.921 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.83 -60.87 2.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.166 -0.47 . . . . 74.35 110.961 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -52.29 -57.07 10.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 75.02 110.843 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -50.84 -58.98 4.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 73.14 110.894 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.8 t -53.89 -40.97 67.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 73.11 110.865 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.93 -44.73 87.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.148 -0.478 . . . . 72.14 110.889 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.72 -60.45 3.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.456 . . . . 74.22 111.034 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -53.56 -47.51 69.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 75.51 110.936 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -48.36 79.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 72.25 110.874 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.45 -42.9 64.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 64.21 111.01 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -69.55 -66.16 0.62 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 74.14 110.968 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.9 m -47.3 -35.94 3.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.241 -0.436 . . . . 74.13 111.083 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 mmmt -69.79 -51.32 34.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.201 -0.454 . . . . 73.22 110.865 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.97 -52.04 53.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.447 . . . . 72.22 111.163 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.41 -46.1 81.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 75.13 110.863 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.93 -52.39 33.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.107 -0.497 . . . . 73.13 110.85 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.87 -54.41 35.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 75.13 111.119 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.06 -41.19 34.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.221 -0.445 . . . . 54.3 110.867 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 41.9 t -78.86 -27.15 13.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.081 -0.509 . . . . 72.52 111.096 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.2 -19.24 62.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 74.43 110.915 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.84 -20.05 66.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.501 . . . . 75.05 111.119 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -58.7 172.49 0.51 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 75.41 110.912 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 99.2 m -51.77 -77.38 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.143 -0.481 . . . . 74.54 111.14 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 19.1 m -137.77 -174.01 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 73.32 111.127 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -104.22 158.18 32.47 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.639 0.733 . . . . 64.23 111.091 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 -7.46 21.09 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.668 2.245 . . . . 72.52 112.377 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -96.43 -39.1 9.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.158 -0.473 . . . . 71.53 110.943 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.424 ' CE1' ' HA ' ' A' ' 118' ' ' ARG . 11.8 t80 -55.31 -60.2 3.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.106 -0.497 . . . . 71.33 110.854 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -45.67 -69.72 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 74.21 111.15 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.1 m -47.76 -38.01 6.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.129 -0.487 . . . . 75.25 111.151 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.1 mtmt -61.47 -45.79 92.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 75.23 110.886 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 69.5 t -61.93 -38.33 80.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 74.5 111.091 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.3 OUTLIER -65.25 -56.61 11.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.28 -0.418 . . . . 72.44 110.822 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.6 pttt -67.17 -21.24 65.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.253 -0.431 . . . . 74.11 110.912 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -71.39 -53.24 14.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 71.23 110.871 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 14.1 mt -91.63 14.99 13.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.238 -0.437 . . . . 75.3 110.943 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.3 m 51.54 38.18 21.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 64.43 110.85 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -79.28 86.75 5.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 74.32 110.827 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.18 155.92 0.18 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 70.51 111.097 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -58.34 -21.65 50.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.173 -0.467 . . . . 75.24 110.91 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -80.68 -53.72 6.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 75.15 110.855 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.08 -47.69 81.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 72.55 110.881 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.5 -32.53 65.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.119 -0.491 . . . . 73.15 111.028 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 26.3 p -80.57 -33.98 35.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.305 -0.407 . . . . 64.13 110.808 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -74.3 -25.7 59.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 73.53 110.881 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 49.7 mt -101.43 -59.76 3.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 75.43 111.132 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -77.99 -62.86 1.54 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 75.43 110.86 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 111.98 50.39 0.59 Allowed Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.77 -0.728 . . . . 63.14 112.538 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -82.12 -44.61 7.49 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.772 -0.728 . . . . 41.52 112.525 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 109.96 167.33 19.82 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.724 -0.75 . . . . 74.32 112.461 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.4 p -56.67 -50.62 73.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.845 0.355 . . . . 63.43 111.124 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -86.18 33.99 0.62 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 71.14 110.934 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.407 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -64.26 -77.17 0.06 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 74.33 111.114 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.407 ' C ' ' O ' ' A' ' 98' ' ' ALA . 47.9 m-85 -37.75 -47.11 0.97 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 75.24 110.854 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.08 -75.39 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.149 -0.478 . . . . 74.31 110.916 -179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 17.2 mtt180 -46.82 -53.64 11.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.093 -0.503 . . . . 75.44 110.865 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -49.6 -39.41 35.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 73.52 110.929 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -51.81 -40.55 60.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.114 -0.494 . . . . 74.53 110.913 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.18 -18.8 22.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.111 -0.495 . . . . 74.44 110.942 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.33 25.88 13.22 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.726 -0.749 . . . . 73.05 112.492 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -92.82 -28.65 16.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.847 0.356 . . . . 71.42 110.926 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -98.13 18.86 15.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 43.5 111.083 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.53 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.9 OUTLIER -121.01 53.87 3.65 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.607 0.718 . . . . 71.15 110.913 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.5 Cg_endo -69.75 27.06 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.652 2.235 . . . . 75.43 112.374 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.731 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.0 m170 70.87 36.02 0.1 Allowed Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 121.649 0.738 . . . . 74.34 110.919 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.731 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.3 Cg_endo -69.74 -165.28 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.608 2.205 . . . . 74.13 112.363 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 12.9 p -82.56 -32.72 28.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 63.14 110.882 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 17.3 m -49.02 -42.73 39.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 73.42 111.068 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 24.4 mm -60.76 -43.5 95.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.253 -0.431 . . . . 75.11 111.13 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -29.67 70.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 73.22 110.929 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 8.1 mp -81.49 -47.61 12.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.236 -0.438 . . . . 74.04 110.9 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.426 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 34.9 mt -56.39 -47.81 78.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.448 . . . . 73.2 110.926 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.424 ' HA ' ' CE1' ' A' ' 73' ' ' PHE . 15.3 ptp180 -55.18 -36.09 65.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 72.2 110.815 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.503 ' HA ' ' CD ' ' A' ' 122' ' ' LYS . 19.9 m -95.91 0.22 10.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.287 -0.415 . . . . 74.33 111.15 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.426 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.5 OUTLIER -92.21 -38.29 12.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.105 -0.498 . . . . 72.21 110.915 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -52.45 -24.4 7.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 72.41 110.844 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.503 ' CD ' ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -100.66 -20.37 15.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.244 -0.434 . . . . 74.04 110.942 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.406 ' HD2' ' CG ' ' A' ' 122' ' ' LYS . 51.0 m-70 -130.19 91.05 40.11 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.547 0.689 . . . . 63.5 110.935 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.69 2.05 3.84 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.658 2.238 . . . . 63.34 112.326 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -116.45 -12.17 11.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.439 . . . . 74.54 110.924 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.8 tp -52.9 -47.4 67.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 73.41 110.955 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.41 ' O ' ' HB3' ' A' ' 131' ' ' ARG . 1.8 pt? -49.7 -29.52 7.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.132 -0.485 . . . . 64.0 110.901 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.474 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.2 m-80 -86.08 -28.41 24.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.46 . . . . 73.41 110.855 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.71 5.36 51.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 74.2 110.936 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.404 HG12 ' HA ' ' A' ' 127' ' ' LEU . 11.4 pt -124.8 -35.18 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 75.14 111.145 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.474 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.6 ptt-85 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 73.22 110.859 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mmt . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.817 0.341 . . . . 71.03 110.852 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.34 -169.14 0.43 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 75.44 110.926 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.0 p -179.83 59.7 0.1 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.611 0.72 . . . . 74.45 110.925 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -4.51 14.18 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.684 2.256 . . . . 74.04 112.332 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 2.1 t -74.43 -62.17 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 73.21 111.14 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.4 t -120.14 -18.58 8.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.861 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 63.65 79.88 0.25 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.252 -0.431 . . . . 72.33 110.848 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -138.52 -75.49 0.38 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 75.22 110.952 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -98.05 -114.27 3.32 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.678 -0.773 . . . . 73.12 112.481 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -170.62 93.94 0.2 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.801 0.334 . . . . 72.33 110.945 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.534 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.7 OUTLIER -54.18 98.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 75.52 110.874 -179.934 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 15.0 p -144.32 131.02 16.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 74.24 111.087 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -44.91 122.75 3.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 73.31 110.831 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.76 81.58 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.713 -0.756 . . . . 74.04 112.509 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -37.89 148.38 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.862 0.363 . . . . 74.44 111.153 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.42 -165.95 1.8 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 73.34 110.939 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.81 116.98 30.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 75.12 110.859 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.9 mm -107.74 91.78 7.91 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.548 0.689 . . . . 74.22 111.096 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 96.29 0.59 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.658 2.239 . . . . 72.51 112.359 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -63.32 -37.6 87.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 75.53 110.956 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 16.4 m -128.78 147.22 50.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.111 -0.495 . . . . 63.33 111.204 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -144.19 37.22 1.25 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 73.4 110.867 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.01 -39.74 1.73 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.193 -0.458 . . . . 75.55 110.897 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -156.76 -58.82 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.67 -0.776 . . . . 64.21 112.441 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.92 46.77 1.35 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.869 0.366 . . . . 74.34 110.888 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -53.74 116.31 2.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 73.32 110.923 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 t -131.58 92.2 3.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.305 -0.407 . . . . 73.42 111.186 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 42.8 t -76.61 127.55 37.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 73.31 111.127 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.79 51.51 2.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 73.25 110.893 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 20.2 mttp -38.99 107.33 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.215 -0.448 . . . . 75.42 110.888 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.67 44.91 0.4 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.75 -0.738 . . . . 73.35 112.496 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 14.3 mm -105.58 90.09 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.885 0.374 . . . . 74.32 111.17 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.77 156.62 37.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 61.35 110.857 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.34 -106.65 0.27 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.784 -0.722 . . . . 62.31 112.507 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.534 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 65.2 mt -155.61 83.95 1.04 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.781 0.324 . . . . 73.12 110.899 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.447 ' CD1' ' N ' ' A' ' 36' ' ' TYR . 0.1 OUTLIER -169.99 149.66 3.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.257 -0.429 . . . . 74.34 110.972 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.2 t -167.47 25.74 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.109 -0.496 . . . . 73.4 110.859 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.9 p 179.29 -34.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 75.2 111.138 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -113.79 176.2 5.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.195 -0.457 . . . . 71.53 110.795 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.58 24.57 1.38 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.485 . . . . 74.13 110.877 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -100.82 -77.42 0.54 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 73.43 110.895 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -78.28 60.75 2.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.475 . . . . 65.02 110.892 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.0 p -87.9 162.77 16.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 74.12 110.892 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 21.1 mm -146.99 139.3 19.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 74.12 111.044 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.2 mtt -142.67 146.02 34.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 73.43 110.869 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.5 m-20 -95.56 -169.09 1.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.158 -0.473 . . . . 64.13 110.88 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -55.12 -60.53 3.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 74.35 110.886 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -52.67 -57.95 8.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.436 . . . . 75.02 110.877 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.53 -59.35 4.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 73.14 110.834 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.6 t -52.82 -42.39 65.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.187 -0.46 . . . . 73.11 110.815 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.25 -44.34 83.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.129 -0.487 . . . . 72.14 110.899 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.89 -61.76 1.97 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 74.22 111.157 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -52.44 -46.87 66.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.25 -0.432 . . . . 75.51 110.855 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.34 -49.57 73.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 72.25 110.889 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.49 -42.12 61.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 64.21 111.035 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -70.32 -66.9 0.54 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.272 -0.422 . . . . 74.14 110.961 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.6 m -46.95 -35.64 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.449 . . . . 74.13 111.109 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.8 mmmm -70.42 -51.95 25.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 73.22 110.912 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.26 -51.49 53.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.277 -0.42 . . . . 72.22 111.143 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.41 -45.81 78.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 75.13 110.935 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.35 -46.86 56.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 73.13 110.863 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.21 -57.52 5.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 75.13 111.078 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.26 -39.2 13.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 54.3 110.85 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.0 t -80.59 -31.28 12.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 72.52 111.126 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -48.46 -32.45 7.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 74.43 110.928 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.11 -45.92 89.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.158 -0.474 . . . . 75.05 111.16 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 47.01 -164.79 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 75.41 110.815 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 98.2 m -97.44 -75.85 0.53 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.07 -0.514 . . . . 74.54 111.133 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 4.7 m -128.35 -168.16 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 73.32 111.095 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -92.83 157.49 39.42 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.509 0.671 . . . . 64.23 111.077 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -6.33 18.35 Favored 'Trans proline' 0 C--N 1.34 0.121 0 C-N-CA 122.669 2.246 . . . . 72.52 112.35 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -92.45 -44.6 8.58 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.23 -0.441 . . . . 71.53 110.834 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -52.9 -62.22 1.79 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 71.33 110.904 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -44.63 -69.97 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.142 -0.481 . . . . 74.21 111.095 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 26.7 m -48.28 -39.17 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.175 -0.466 . . . . 75.25 111.12 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -59.68 -47.21 86.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 75.23 110.898 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 98.7 t -60.29 -39.4 80.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 74.5 111.146 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.06 -60.39 3.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 72.44 110.793 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -63.89 -22.72 67.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.257 -0.429 . . . . 74.11 110.864 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 14.2 ttmm -68.18 -54.71 15.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.462 . . . . 71.23 110.904 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.2 mt -91.6 15.91 11.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.241 -0.436 . . . . 75.3 110.902 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.88 39.53 26.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 64.43 110.811 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -79.34 86.15 5.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.144 -0.48 . . . . 74.32 110.937 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -44.95 156.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.247 -0.433 . . . . 70.51 111.109 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -59.04 -20.6 54.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 75.24 110.951 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -81.35 -53.69 6.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 75.15 110.909 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -59.57 -48.66 80.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.47 . . . . 72.55 110.81 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.12 -32.87 64.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.178 -0.465 . . . . 73.15 111.11 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 28.6 t -79.42 -31.63 42.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 64.13 110.828 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -79.47 -24.24 42.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 73.53 110.894 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 50.7 mt -103.61 -62.07 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.481 . . . . 75.43 111.158 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -75.31 -64.16 1.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.173 -0.467 . . . . 75.43 110.85 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 116.73 49.33 0.43 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.718 -0.753 . . . . 63.14 112.519 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -82.95 -45.39 6.7 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.701 -0.761 . . . . 41.52 112.434 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 109.66 166.89 20.05 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.762 -0.733 . . . . 74.32 112.489 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.7 p -50.91 -51.69 19.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.827 0.346 . . . . 63.43 111.096 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 28.2 m-20 -87.23 40.21 0.91 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 71.14 110.886 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.404 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -63.86 -78.22 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.226 -0.443 . . . . 74.33 111.073 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.404 ' C ' ' O ' ' A' ' 98' ' ' ALA . 40.6 m-85 -38.2 -42.55 0.69 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.165 -0.471 . . . . 75.24 110.932 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.0 t -60.02 -74.81 0.07 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.181 -0.463 . . . . 74.31 110.851 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 34.6 mtt85 -49.64 -46.8 49.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.164 -0.471 . . . . 75.44 110.931 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -56.63 -35.47 68.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.149 -0.478 . . . . 73.52 110.886 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -77.86 -3.77 43.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 74.53 110.894 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.2 -19.1 10.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 74.44 110.927 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.84 19.83 35.79 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.703 -0.761 . . . . 73.05 112.495 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.1 m-20 -98.39 -29.51 13.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.764 0.316 . . . . 71.42 110.826 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -99.16 26.05 6.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 43.5 111.063 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.553 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 0.0 OUTLIER -126.37 47.51 2.44 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.606 0.717 . . . . 71.15 110.937 -179.982 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.553 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.4 Cg_endo -69.7 24.94 0.17 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.669 2.246 . . . . 75.43 112.333 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.736 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 15.2 t-160 69.98 35.15 0.1 OUTLIER Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.586 0.707 . . . . 74.34 110.857 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.736 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.2 Cg_endo -69.82 -165.31 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.711 2.274 . . . . 74.13 112.259 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.5 t -79.84 -29.86 40.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.161 -0.472 . . . . 63.14 110.882 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 39.7 m -52.41 -39.25 60.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.161 -0.472 . . . . 73.42 111.184 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.518 HD11 ' HG2' ' A' ' 108' ' ' GLN . 33.1 mm -63.45 -44.3 98.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.456 . . . . 75.11 111.138 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -29.16 69.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.128 -0.487 . . . . 73.22 110.858 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 8.1 mp -81.94 -44.93 16.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.277 -0.42 . . . . 74.04 110.916 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.437 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 39.8 mt -59.59 -48.27 82.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.456 . . . . 73.2 110.856 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -54.11 -37.61 64.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.228 -0.442 . . . . 72.2 110.928 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 27.4 m -91.88 -8.6 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 74.33 111.095 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.437 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.5 OUTLIER -83.24 -40.06 20.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 72.21 110.917 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -49.72 -31.31 11.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 72.41 110.873 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.93 -19.69 17.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 74.04 110.908 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 34.9 m-70 -127.76 87.03 56.88 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.591 0.71 . . . . 63.5 110.875 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 3.37 2.83 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.703 2.269 . . . . 63.34 112.35 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -116.97 -12.7 10.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 74.54 110.92 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 5.1 tp -53.97 -46.68 71.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.466 . . . . 73.41 110.941 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.407 ' O ' ' HB3' ' A' ' 131' ' ' ARG . 1.7 pt? -49.65 -29.43 7.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.459 . . . . 64.0 110.912 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.47 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.56 -27.93 23.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 73.41 110.864 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -94.15 4.96 53.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 74.2 110.955 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.4 HG12 ' HA ' ' A' ' 127' ' ' LEU . 11.7 pt -124.24 -35.01 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 75.14 111.139 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.47 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.4 ptt-85 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 73.22 110.922 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.849 0.357 . . . . 71.03 110.949 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.75 -170.39 0.48 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 75.44 110.905 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.412 ' C ' ' H ' ' A' ' 5' ' ' VAL . 1.6 p 178.99 56.96 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.555 0.693 . . . . 74.45 110.904 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 7.28 1.02 Allowed 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.658 2.239 . . . . 74.04 112.381 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.412 ' H ' ' C ' ' A' ' 3' ' ' CYS . 3.5 m -102.27 -43.3 9.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 73.21 111.114 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.9 -31.92 4.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.192 -0.458 . . . . 74.21 110.915 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 63.5 49.06 3.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.148 -0.478 . . . . 72.33 110.859 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 72.6 mm-40 -117.13 -75.6 0.58 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 75.22 110.881 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.401 ' HA3' ' HB3' ' A' ' 39' ' ' HIS . . . -93.76 -117.14 2.71 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.728 -0.749 . . . . 73.12 112.561 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -174.08 93.27 0.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.857 0.36 . . . . 72.33 110.887 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.511 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.2 ptp -52.65 106.1 0.15 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 75.52 110.931 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.5 p -147.41 127.81 5.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.238 -0.437 . . . . 74.24 111.176 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -45.38 127.45 7.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 73.31 110.864 -179.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.95 81.74 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.741 -0.742 . . . . 74.04 112.467 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -37.38 147.34 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.887 0.375 . . . . 74.44 111.12 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.32 -165.77 1.77 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 73.34 110.906 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.38 116.66 29.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 75.12 110.856 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.0 mm -107.62 92.44 8.62 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.644 0.735 . . . . 74.22 111.138 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 96.88 0.61 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.688 2.259 . . . . 72.51 112.345 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -62.65 -38.45 90.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 75.53 110.93 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 16.8 m -129.04 145.38 51.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.071 -0.513 . . . . 63.33 111.125 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -135.48 46.51 2.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 73.4 110.886 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.79 -68.39 0.64 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.163 -0.471 . . . . 75.55 110.908 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -137.21 -42.71 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.718 -0.754 . . . . 64.21 112.463 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.03 39.4 1.23 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.852 0.358 . . . . 74.34 110.865 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.8 tttm -51.64 117.27 2.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.287 -0.415 . . . . 73.32 110.915 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 t -129.66 92.15 3.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.257 -0.429 . . . . 73.42 111.119 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 40.4 t -76.77 127.18 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 73.31 111.189 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.83 51.92 2.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.474 . . . . 73.25 110.885 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.1 mttm -39.14 106.94 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 75.42 110.899 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.91 45.3 0.38 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.795 -0.717 . . . . 73.35 112.498 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 14.4 mm -105.93 91.3 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.834 0.35 . . . . 74.32 111.195 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.85 158.59 33.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.246 -0.434 . . . . 61.35 110.848 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 163.11 -105.99 0.27 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.709 -0.758 . . . . 62.31 112.45 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.511 ' HB3' ' HB2' ' A' ' 11' ' ' MET . 46.9 mt -156.67 83.4 0.96 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.789 0.328 . . . . 73.12 110.952 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' A' ' 36' ' ' TYR . 0.1 OUTLIER -168.96 169.44 9.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.204 -0.453 . . . . 74.34 110.906 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.51 -33.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.061 -0.518 . . . . 73.4 110.909 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 p -120.23 -45.76 2.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 75.2 111.098 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.401 ' HB3' ' HA3' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -99.4 178.44 4.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 71.53 110.821 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 24.1 p -148.88 29.95 0.81 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.206 -0.452 . . . . 74.13 110.887 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -104.52 -77.27 0.58 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.453 . . . . 73.43 110.865 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -77.55 59.95 2.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.504 . . . . 65.02 110.881 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.7 p -83.74 158.88 21.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 74.12 110.832 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 28.1 mm -144.34 140.81 24.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.1 -0.5 . . . . 74.12 111.08 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.9 mtt -144.76 142.38 29.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.136 -0.484 . . . . 73.43 110.834 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.0 m-20 -90.76 -172.96 3.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 64.13 110.894 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.52 -62.1 1.84 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.47 . . . . 74.35 110.932 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -51.05 -58.17 6.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.155 -0.475 . . . . 75.02 110.885 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -49.13 -59.12 3.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 73.14 110.861 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.9 t -53.46 -42.05 66.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 73.11 110.895 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.24 -44.1 83.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.136 -0.484 . . . . 72.14 110.867 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.33 -61.37 2.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 74.22 111.048 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -52.83 -46.66 67.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 75.51 110.873 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.55 -49.61 72.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.49 . . . . 72.25 110.853 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.61 -42.77 62.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.276 -0.42 . . . . 64.21 111.033 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -70.04 -66.79 0.55 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 74.14 110.879 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.7 m -46.68 -35.63 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 74.13 111.134 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -70.56 -51.01 31.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.468 . . . . 73.22 110.857 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.74 -51.18 58.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.302 -0.408 . . . . 72.22 111.038 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -67.34 -45.09 77.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.25 -0.432 . . . . 75.13 110.894 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 -50.63 -50.55 53.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.177 -0.465 . . . . 73.13 110.88 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.24 -56.26 12.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.452 . . . . 75.13 111.156 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -46.67 -42.99 17.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 54.3 110.892 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.3 t -74.09 -34.33 38.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 72.52 111.146 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -48.2 -34.07 9.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.43 110.882 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -52.77 -48.13 67.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 75.05 111.098 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 40.95 -99.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.153 -0.476 . . . . 75.41 110.884 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 88.3 m -50.87 -75.7 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 74.54 111.159 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 15.7 m -149.24 -175.6 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 73.32 111.145 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -102.99 154.14 37.77 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.601 0.715 . . . . 64.23 111.118 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 -7.67 21.65 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.721 2.281 . . . . 72.52 112.31 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -95.98 -38.92 10.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 71.53 110.88 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.419 ' CE1' ' HA ' ' A' ' 118' ' ' ARG . 12.3 t80 -56.23 -59.98 4.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.49 . . . . 71.33 110.9 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -45.22 -68.79 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.104 -0.498 . . . . 74.21 111.16 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.6 m -48.75 -39.1 10.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 75.25 111.144 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -61.04 -38.19 85.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 75.23 110.875 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.2 t -70.88 -37.15 67.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.247 -0.433 . . . . 74.5 111.163 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.81 -33.16 70.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 72.44 110.857 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.37 -20.1 24.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.195 -0.457 . . . . 74.11 110.936 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.2 ttmm -76.19 -51.5 11.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 71.23 110.956 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.3 mt -89.89 13.56 14.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.237 -0.438 . . . . 75.3 110.914 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.24 42.16 28.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 64.43 110.953 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -78.73 85.03 4.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.041 -0.527 . . . . 74.32 110.904 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.22 156.66 0.15 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.124 -0.489 . . . . 70.51 111.086 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -57.64 -23.01 48.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 75.24 110.911 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.0 mttm -79.47 -53.29 7.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 75.15 110.904 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -63.66 -53.72 47.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 72.55 110.905 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.65 -36.31 61.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.087 -0.506 . . . . 73.15 111.147 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.7 t -79.01 -28.81 43.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 64.13 110.824 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -78.08 -29.56 49.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.108 -0.496 . . . . 73.53 110.885 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 18.3 mm -98.8 -58.24 3.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.096 -0.502 . . . . 75.43 111.18 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -77.11 -64.36 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 75.43 110.842 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 110.54 45.37 0.91 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.786 -0.721 . . . . 63.14 112.479 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.71 -45.04 93.95 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.67 -0.776 . . . . 41.52 112.513 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.04 172.23 21.75 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.72 -0.752 . . . . 74.32 112.464 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -50.53 -66.52 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.873 0.368 . . . . 63.43 111.161 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -86.21 42.4 0.99 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.471 . . . . 71.14 110.945 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.41 -76.17 0.06 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.124 -0.489 . . . . 74.33 111.084 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -39.69 -39.49 0.77 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.433 . . . . 75.24 110.866 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.9 m -61.01 -76.31 0.05 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 74.31 110.89 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 29.0 mtt85 -50.04 -45.61 52.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 75.44 110.855 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -57.6 -37.22 72.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 73.52 110.941 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -62.75 -16.92 59.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 74.53 110.86 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.94 -20.54 12.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.238 -0.437 . . . . 74.44 110.926 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.8 28.75 11.65 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.724 -0.75 . . . . 73.05 112.458 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -106.71 -8.55 16.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.846 0.355 . . . . 71.42 110.905 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -115.06 13.65 16.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 43.5 111.088 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.478 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -126.48 55.72 14.75 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.618 0.723 . . . . 71.15 110.863 -179.899 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.477 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.5 Cg_endo -69.78 36.54 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.661 2.241 . . . . 75.43 112.358 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.753 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 1.0 OUTLIER 72.05 33.92 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.551 0.691 . . . . 74.34 110.828 179.917 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.753 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.2 Cg_endo -69.7 -164.14 0.12 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.722 2.281 . . . . 74.13 112.364 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.35 -32.81 32.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 63.14 110.861 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 22.7 m -52.7 -54.09 38.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.158 -0.474 . . . . 73.42 111.18 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 46.4 mm -50.95 -45.24 28.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 75.11 111.165 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -29.51 70.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 73.22 110.89 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.3 mp -80.01 -49.86 11.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.199 -0.455 . . . . 74.04 110.917 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.441 ' HA ' ' HB2' ' A' ' 120' ' ' LEU . 20.6 mt -55.42 -47.97 75.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 73.2 110.91 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.419 ' HA ' ' CE1' ' A' ' 73' ' ' PHE . 17.3 ptp180 -55.18 -35.54 64.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 72.2 110.908 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.473 ' HA ' ' HD3' ' A' ' 122' ' ' LYS . 18.8 m -96.95 0.32 10.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 74.33 111.132 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.441 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . 0.7 OUTLIER -93.1 -36.52 12.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 72.21 110.878 179.95 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -53.03 -24.37 9.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.12 -0.491 . . . . 72.41 110.882 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.473 ' HD3' ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -99.7 -20.2 16.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 74.04 110.935 179.982 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -132.52 93.4 25.02 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.604 0.716 . . . . 63.5 110.934 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 -0.02 6.32 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.7 2.267 . . . . 63.34 112.333 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -114.31 -11.34 12.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.259 -0.428 . . . . 74.54 110.902 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 7.8 tp -53.27 -49.15 67.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.122 -0.49 . . . . 73.41 110.861 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.425 ' HA ' HG12 ' A' ' 130' ' ' ILE . 2.0 pt? -51.28 -28.86 13.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.276 -0.42 . . . . 64.0 110.863 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.466 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.36 -27.11 24.46 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.216 -0.447 . . . . 73.41 110.844 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -94.12 2.46 55.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.269 -0.423 . . . . 74.2 110.899 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.425 HG12 ' HA ' ' A' ' 127' ' ' LEU . 13.3 pt -121.47 -34.26 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 75.14 111.176 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.466 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 2.5 ptt-85 . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.104 -0.498 . . . . 73.22 110.826 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mtt . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.867 0.365 . . . . 71.030000000000001 110.88 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.34 -170.58 0.53 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 75.439999999999998 110.846 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.435 ' O ' ' N ' ' A' ' 7' ' ' HIS . 0.1 OUTLIER 174.27 59.1 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.596 0.713 . . . . 43.340000000000003 110.847 179.922 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -2.64 10.54 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.689 2.259 . . . . 71.420000000000002 112.328 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.466 HG23 ' N ' ' A' ' 6' ' ' CYS . 30.5 m -84.08 -43.14 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.255 -0.429 . . . . 73.209999999999994 111.106 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.466 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.8 OUTLIER -125.77 -28.62 3.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 61.32 110.888 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.435 ' N ' ' O ' ' A' ' 3' ' ' CYS . 19.0 m80 67.66 46.31 1.35 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 72.329999999999998 110.878 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -107.6 -74.05 0.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.434 . . . . 75.219999999999999 110.872 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.81 -134.72 8.55 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.719 -0.753 . . . . 52.109999999999999 112.483 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.477 ' O ' HG12 ' A' ' 12' ' ' VAL . 5.9 pt-20 -155.19 88.26 1.16 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 70.420000000000002 110.863 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.551 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -48.97 105.5 0.08 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 75.519999999999996 110.895 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.477 HG12 ' O ' ' A' ' 10' ' ' GLU . 3.9 p -142.01 126.65 16.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 64.129999999999995 111.145 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.586 ' N ' HD23 ' A' ' 35' ' ' LEU . 2.4 p -49.09 130.98 19.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 73.310000000000002 110.865 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.411 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 178.94 80.76 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.748 -0.739 . . . . 74.040000000000006 112.464 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.415 HD12 ' N ' ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.12 146.83 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.93 0.395 . . . . 74.439999999999998 111.108 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.8 -165.51 1.66 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.124 -0.489 . . . . 73.340000000000003 110.893 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.679 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -95.59 116.97 29.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.235 -0.439 . . . . 75.120000000000005 110.907 179.861 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.713 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.2 mm -107.59 91.96 7.93 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.652 0.739 . . . . 71.030000000000001 111.142 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.431 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.9 Cg_endo -69.76 96.89 0.61 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.654 2.236 . . . . 61.100000000000001 112.344 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.425 ' HB3' HG23 ' A' ' 27' ' ' THR . 15.0 t80 -64.5 -36.92 85.74 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 63.409999999999997 110.919 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.491 HG21 ' HG2' ' A' ' 25' ' ' ARG . 16.7 m -128.87 146.79 50.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 61.119999999999997 111.139 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.8 p90 -143.87 36.18 1.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 73.400000000000006 110.882 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.55 -40.23 2.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 71.450000000000003 110.854 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -157.42 -57.92 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.713 -0.756 . . . . 64.209999999999994 112.478 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.491 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -91.18 46.31 1.3 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.876 0.37 . . . . 74.319999999999993 110.882 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.414 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 14.4 tttm -53.09 116.48 2.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 73.319999999999993 110.887 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.425 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -130.74 92.55 3.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 73.420000000000002 111.123 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.679 HG11 ' HB2' ' A' ' 17' ' ' ASP . 44.5 t -77.07 127.55 38.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 73.310000000000002 111.073 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.742 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -85.05 51.43 2.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 62.310000000000002 110.893 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 29' ' ' LEU . 19.0 mttm -38.08 107.69 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 71.219999999999999 110.933 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 119.45 46.58 0.4 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.764 -0.732 . . . . 72.209999999999994 112.534 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.576 HD11 ' HB3' ' A' ' 29' ' ' LEU . 15.1 mm -107.73 91.69 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.884 0.373 . . . . 61.5 111.117 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.27 154.61 38.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 61.350000000000001 110.883 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 168.32 -109.33 0.33 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.761 -0.733 . . . . 52.539999999999999 112.502 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.74 HD12 ' HB ' ' A' ' 44' ' ' ILE . 53.8 mt -156.98 87.0 0.98 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.856 0.36 . . . . 71.400000000000006 110.897 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -159.73 160.18 33.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 74.140000000000001 110.921 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.7 t -171.82 -40.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.137 -0.483 . . . . 73.400000000000006 110.905 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 39' ' ' HIS . 2.6 p -120.9 -46.54 2.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 53.439999999999998 111.139 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.407 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -92.1 170.65 9.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.494 . . . . 71.530000000000001 110.807 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.47 21.12 2.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.196 -0.456 . . . . 74.129999999999995 110.877 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -112.0 -61.79 1.66 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 54.200000000000003 110.863 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.526 ' HG3' ' HE3' ' A' ' 11' ' ' MET . 11.5 tp10 -77.34 61.67 2.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 65.019999999999996 110.874 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.0 p -95.24 154.28 17.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 74.120000000000005 110.859 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.74 ' HB ' HD12 ' A' ' 35' ' ' LEU . 19.0 mm -140.89 139.84 33.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 74.120000000000005 111.136 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.6 mtt -142.15 143.84 33.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 73.230000000000004 110.909 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.1 m-20 -92.51 -169.67 2.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.236 -0.438 . . . . 64.129999999999995 110.893 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -60.92 2.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 53.329999999999998 110.902 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.91 -57.58 8.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.262 -0.427 . . . . 74.319999999999993 110.857 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.72 -58.01 6.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 70.329999999999998 110.865 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.8 t -53.65 -42.64 68.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 71.310000000000002 110.809 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.2 -44.14 83.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.164 -0.471 . . . . 72.140000000000001 110.856 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.14 -62.08 1.75 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 63.450000000000003 111.093 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.463 ' O ' HG13 ' A' ' 57' ' ' VAL . 20.8 t80 -52.05 -46.21 65.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 75.510000000000005 110.834 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.42 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.94 -51.33 64.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 72.25 110.905 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -50.51 -40.24 50.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.444 . . . . 62.539999999999999 111.099 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.742 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -72.07 -67.85 0.51 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 50.130000000000003 110.902 -179.928 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.463 HG13 ' O ' ' A' ' 53' ' ' PHE . 15.2 m -46.47 -36.87 3.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.448 . . . . 74.129999999999995 111.135 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.62 -50.73 33.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 73.219999999999999 110.908 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.11 -50.99 60.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 72.219999999999999 111.066 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.637 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -66.53 -46.16 77.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 72.140000000000001 110.874 -179.888 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.48 -51.51 35.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.133 -0.485 . . . . 72.019999999999996 110.872 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.37 -54.68 25.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 75.129999999999995 111.095 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.08 -40.53 32.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.243 -0.435 . . . . 54.299999999999997 110.86 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.637 HG23 ' O ' ' A' ' 60' ' ' PHE . 42.4 t -79.68 -27.4 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.132 -0.485 . . . . 72.400000000000006 111.15 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 74.219999999999999 110.905 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 4.6 m . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.847 0.356 . . . . 73.319999999999993 111.1 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.535 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.02 159.41 29.74 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.587 0.708 . . . . 43.119999999999997 111.079 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.683 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.3 Cg_endo -69.8 -7.54 21.34 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.682 2.255 . . . . 72.519999999999996 112.292 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -92.19 -39.5 11.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 71.530000000000001 110.876 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -57.34 -61.17 2.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 71.329999999999998 110.88 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.683 HD11 ' HA ' ' A' ' 71' ' ' PRO . 0.3 OUTLIER -44.74 -68.11 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 74.209999999999994 111.136 179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.1 m -48.85 -39.09 11.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 71.120000000000005 111.144 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.6 mtmt -60.4 -39.41 87.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 74.409999999999997 110.9 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.458 ' HB ' HD22 ' A' ' 117' ' ' LEU . 99.6 t -70.35 -37.97 72.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 74.5 111.167 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.66 -33.33 72.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 54.240000000000002 110.859 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.1 pttt -89.53 -19.25 25.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 74.109999999999999 110.886 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 21.8 ttmt -75.97 -51.19 12.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 71.230000000000004 110.87 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.851 HD13 HD12 ' A' ' 120' ' ' LEU . 8.3 mt -92.09 14.66 15.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.205 -0.452 . . . . 64.349999999999994 110.915 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.32 41.13 27.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 54.039999999999999 110.881 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.842 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.5 mm? -79.04 86.46 4.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.138 -0.483 . . . . 70.209999999999994 110.872 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.668 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -45.83 156.05 0.15 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 63.520000000000003 111.157 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.23 -19.41 54.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 75.239999999999995 110.883 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -53.21 6.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 73.010000000000005 110.917 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.668 ' H ' HG23 ' A' ' 84' ' ' THR . 1.2 tt0 -62.63 -49.34 75.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.234 -0.439 . . . . 64.099999999999994 110.946 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.443 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -55.57 -31.64 62.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 73.150000000000006 111.153 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 24.5 p -80.02 -35.79 36.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 62.399999999999999 110.885 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -74.81 -22.82 58.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.09 -0.504 . . . . 63.229999999999997 110.904 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.704 ' CD1' HD12 ' A' ' 127' ' ' LEU . 52.8 mt -103.71 -62.87 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 61.130000000000003 111.142 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.552 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.8 m-85 -75.64 -63.95 1.18 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 75.430000000000007 110.902 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 124.69 34.36 0.7 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.731 -0.747 . . . . 44.310000000000002 112.475 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -52.01 -50.14 46.2 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.743 -0.741 . . . . 41.520000000000003 112.51 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.95 -137.11 13.88 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.739 -0.743 . . . . 71.530000000000001 112.526 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.14 -73.36 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.781 0.324 . . . . 62.219999999999999 111.147 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -85.25 40.94 0.85 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 71.140000000000001 110.89 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -60.35 -75.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 55.140000000000001 111.053 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.417 ' C ' ' O ' ' A' ' 98' ' ' ALA . 25.4 m-85 -36.38 -47.03 0.58 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 75.239999999999995 110.849 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.1 m -57.38 -76.08 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.481 . . . . 74.310000000000002 110.899 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.531 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 8.0 mtt180 -47.39 -52.8 15.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.08 -0.509 . . . . 64.230000000000004 110.859 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.568 ' HB3' HD12 ' A' ' 74' ' ' ILE . 10.6 m-85 -49.67 -38.26 31.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 64.349999999999994 110.923 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -54.33 -38.85 66.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.13 -0.486 . . . . 74.530000000000001 110.894 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.22 -17.32 22.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.139 -0.482 . . . . 61.219999999999999 110.916 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.28 26.19 16.7 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.751 -0.738 . . . . 73.049999999999997 112.47 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 74.7 m-80 -94.3 -24.65 17.34 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.863 0.363 . . . . 71.230000000000004 110.925 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.531 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -105.05 18.7 21.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 22.02 111.085 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.495 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.1 OUTLIER -120.39 55.98 4.39 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.637 0.732 . . . . 71.140000000000001 110.941 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.4 Cg_endo -69.77 28.67 0.18 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.664 2.243 . . . . 64.450000000000003 112.334 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.694 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.9 OUTLIER 69.42 38.37 0.17 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.547 0.689 . . . . 74.340000000000003 110.842 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.694 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.5 Cg_endo -69.7 -165.49 0.15 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.689 2.259 . . . . 74.129999999999995 112.369 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 14.1 m -81.46 -34.41 31.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 63.140000000000001 110.845 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.552 HG23 ' HB3' ' A' ' 92' ' ' PHE . 14.8 m -48.78 -42.34 35.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 73.420000000000002 111.192 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.421 HD11 ' HG2' ' A' ' 108' ' ' GLN . 27.7 mm -60.26 -44.0 94.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 62.530000000000001 111.133 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.658 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -64.18 -29.34 70.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.169 -0.469 . . . . 73.219999999999999 110.864 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.658 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.6 mp -81.24 -42.83 20.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.244 -0.435 . . . . 74.040000000000006 110.881 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.638 HD13 HG22 ' A' ' 74' ' ' ILE . 36.1 mt -61.09 -49.45 77.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 65.230000000000004 110.925 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.561 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.7 ptp180 -51.92 -39.76 59.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 60.539999999999999 110.914 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.561 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.8 m -88.13 -13.01 10.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 73.219999999999999 111.092 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.851 HD12 HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -79.06 -41.35 29.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 72.209999999999994 110.874 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -48.79 -32.82 9.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 72.409999999999997 110.876 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.2 -21.39 17.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 73.219999999999999 110.941 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.74 ' O ' HD13 ' A' ' 120' ' ' LEU . 42.1 m-70 -126.52 87.66 55.94 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.552 0.691 . . . . 61.530000000000001 110.863 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.658 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.5 Cg_endo -69.71 3.37 2.78 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.692 2.261 . . . . 63.340000000000003 112.392 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -117.22 -12.45 10.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.177 -0.465 . . . . 74.540000000000006 110.898 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.663 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.2 tp -54.06 -46.57 72.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.168 -0.469 . . . . 71.219999999999999 110.932 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.704 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.73 -29.42 7.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 64.0 110.891 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.506 HD21 HH12 ' A' ' 131' ' ' ARG . 6.4 m120 -86.59 -27.55 23.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 73.409999999999997 110.885 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.43 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -94.68 5.03 53.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 71.439999999999998 110.859 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 126' ' ' LEU . 11.6 pt -124.29 -35.12 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.471 . . . . 75.140000000000001 111.117 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.506 HH12 HD21 ' A' ' 128' ' ' ASN . 1.2 ptt-85 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.178 -0.465 . . . . 65.420000000000002 110.893 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.51 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.895 0.379 . . . . 71.030000000000001 110.917 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.83 -169.04 0.39 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 75.439999999999998 110.893 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.8 p 176.73 59.86 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.382 0 CA-C-O 121.576 0.703 . . . . 43.340000000000003 110.883 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.84 4.8 2.02 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.646 2.231 . . . . 71.420000000000002 112.297 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.2 m -104.01 -45.79 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.436 . . . . 73.209999999999994 111.141 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.4 m -107.77 -34.15 7.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 61.32 110.885 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 61.03 46.45 8.3 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.089 -0.505 . . . . 72.329999999999998 110.896 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -109.35 -74.21 0.66 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.166 -0.47 . . . . 75.219999999999999 110.943 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.541 ' HA3' HG23 ' A' ' 38' ' ' VAL . . . -107.95 -106.9 3.12 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.695 -0.764 . . . . 52.109999999999999 112.535 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.51 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 5.5 pt-20 -176.56 96.37 0.05 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.89 0.376 . . . . 70.420000000000002 110.889 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.595 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.8 ptp -52.58 104.76 0.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.168 -0.469 . . . . 75.519999999999996 110.92 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.497 HG12 ' O ' ' A' ' 10' ' ' GLU . 4.2 p -143.02 126.1 13.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.254 -0.43 . . . . 64.129999999999995 111.151 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.595 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -49.77 128.37 17.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.124 -0.489 . . . . 73.310000000000002 110.861 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.416 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.26 84.28 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.778 -0.725 . . . . 74.040000000000006 112.532 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.416 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.67 145.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.872 0.368 . . . . 74.439999999999998 111.146 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.53 -167.28 2.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 73.340000000000003 110.856 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.692 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -93.44 118.15 30.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 75.120000000000005 110.86 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.736 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.3 mm -109.28 91.17 9.28 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.667 0.746 . . . . 71.030000000000001 111.161 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.473 ' HA ' HG22 ' A' ' 28' ' ' VAL . 54.3 Cg_endo -69.67 95.81 0.56 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.745 2.297 . . . . 61.100000000000001 112.404 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -63.43 -37.27 86.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 63.409999999999997 110.901 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.485 HG21 ' HG2' ' A' ' 25' ' ' ARG . 19.2 m -131.21 149.67 52.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.091 -0.504 . . . . 61.119999999999997 111.205 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -148.51 44.22 1.02 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.27 -0.423 . . . . 73.400000000000006 110.926 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.29 -46.14 0.77 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.117 -0.492 . . . . 71.450000000000003 110.84 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -149.08 -50.46 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.67 -0.776 . . . . 64.209999999999994 112.469 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.485 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -101.7 47.1 0.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.912 0.387 . . . . 74.319999999999993 110.876 -179.827 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.428 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 14.8 tttt -55.33 121.62 9.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 73.319999999999993 110.9 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.416 HG23 ' O ' ' A' ' 27' ' ' THR . 1.8 t -138.52 93.83 2.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 73.420000000000002 111.134 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.692 HG11 ' HB2' ' A' ' 17' ' ' ASP . 44.2 t -77.55 128.14 38.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 73.310000000000002 111.104 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.745 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.2 OUTLIER -84.51 51.92 2.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 62.310000000000002 110.955 179.906 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 29' ' ' LEU . 29.0 mttp -37.4 107.7 0.07 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 71.219999999999999 110.859 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.27 50.05 0.39 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.713 -0.756 . . . . 72.209999999999994 112.478 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.6 HD11 ' HB3' ' A' ' 29' ' ' LEU . 19.0 mm -109.36 93.04 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.787 0.327 . . . . 61.5 111.166 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.27 150.7 38.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 61.350000000000001 110.822 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.9 -106.12 0.25 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.805 -0.712 . . . . 52.539999999999999 112.501 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.774 HD12 ' HB ' ' A' ' 44' ' ' ILE . 43.5 mt -156.65 84.82 0.97 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.875 0.369 . . . . 71.400000000000006 110.873 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.497 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -158.74 162.51 37.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 74.140000000000001 110.916 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.2 t -171.28 -37.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.094 -0.503 . . . . 73.400000000000006 110.904 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.541 HG23 ' HA3' ' A' ' 9' ' ' GLY . 0.3 OUTLIER -128.13 -40.56 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 53.439999999999998 111.141 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -97.05 170.89 8.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.129 -0.487 . . . . 71.530000000000001 110.835 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.25 12.96 2.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.216 -0.447 . . . . 74.129999999999995 110.866 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -103.07 -65.2 1.01 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 54.200000000000003 110.872 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -76.98 61.46 1.97 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.193 -0.458 . . . . 65.019999999999996 110.886 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.5 m -102.06 160.6 14.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 74.120000000000005 110.814 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.774 ' HB ' HD12 ' A' ' 35' ' ' LEU . 15.3 mm -141.14 140.79 31.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.118 -0.492 . . . . 74.120000000000005 111.135 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 16.2 mtm -143.8 132.45 22.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.087 -0.506 . . . . 73.230000000000004 110.889 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 35.8 m-20 -82.65 -169.72 2.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 64.129999999999995 110.871 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -61.44 2.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 53.329999999999998 110.87 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -51.63 -57.47 9.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.406 . . . . 74.319999999999993 110.872 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -50.54 -57.08 8.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 70.329999999999998 110.94 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.0 t -55.08 -40.06 69.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.495 . . . . 71.310000000000002 110.871 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.44 -45.62 88.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.129 -0.487 . . . . 72.140000000000001 110.877 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.22 -59.98 3.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 63.450000000000003 111.096 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.432 ' O ' HG13 ' A' ' 57' ' ' VAL . 14.8 t80 -53.32 -48.51 68.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.267 -0.424 . . . . 75.510000000000005 110.832 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.423 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.28 -48.48 79.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 72.25 110.886 179.956 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.2 -41.51 62.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 62.539999999999999 111.137 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.745 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -70.28 -66.67 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 50.130000000000003 110.854 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.458 HG12 HD21 ' A' ' 29' ' ' LEU . 12.0 m -47.5 -35.79 4.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.275 -0.42 . . . . 74.129999999999995 111.148 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -69.43 -54.48 14.17 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.188 -0.46 . . . . 73.219999999999999 110.858 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.16 -52.25 27.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 72.219999999999999 111.116 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.629 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -63.32 -48.61 77.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.204 -0.453 . . . . 72.140000000000001 110.88 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.8 -36.49 37.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 72.019999999999996 110.856 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.58 -53.75 9.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.462 . . . . 75.129999999999995 111.116 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.34 -25.73 64.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 54.299999999999997 110.84 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.629 HG22 ' O ' ' A' ' 60' ' ' PHE . 16.3 m -97.48 -16.24 7.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.467 . . . . 72.400000000000006 111.092 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.23 -0.441 . . . . 74.219999999999999 110.899 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 10.8 m . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.768 0.318 . . . . 73.319999999999993 111.169 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.537 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -105.24 159.44 29.4 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.559 0.695 . . . . 43.119999999999997 111.105 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.644 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.2 Cg_endo -69.79 -7.37 20.9 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.686 2.258 . . . . 72.519999999999996 112.369 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -92.26 -38.72 11.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.434 . . . . 71.530000000000001 110.832 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -57.58 -61.36 2.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 71.329999999999998 110.898 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.804 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -45.15 -67.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 74.209999999999994 111.183 179.933 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.8 m -48.88 -39.33 11.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 71.120000000000005 111.098 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 23.1 mtmt -61.14 -45.04 96.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 74.409999999999997 110.864 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.596 HG22 ' HB2' ' A' ' 121' ' ' ASP . 75.8 t -61.81 -39.05 82.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.234 -0.439 . . . . 74.5 111.118 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.451 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -64.37 -58.71 5.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 54.240000000000002 110.924 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -24.91 67.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 74.109999999999999 110.937 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 18.5 ttmt -68.23 -52.02 38.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.184 -0.462 . . . . 71.230000000000004 110.898 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.847 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.5 mt -91.82 12.53 21.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 64.349999999999994 110.898 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.1 t 53.74 37.48 26.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 54.039999999999999 110.898 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.847 HD23 ' HB2' ' A' ' 81' ' ' LEU . 2.0 mm? -79.69 87.31 5.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 70.209999999999994 110.922 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.644 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.73 156.38 0.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 63.520000000000003 111.129 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.14 -21.15 58.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 75.239999999999995 110.899 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -50.13 10.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.254 -0.43 . . . . 73.010000000000005 110.873 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.644 ' H ' HG23 ' A' ' 84' ' ' THR . 0.9 OUTLIER -64.95 -53.0 53.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 64.099999999999994 110.84 179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -52.19 -33.66 41.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.135 -0.484 . . . . 73.150000000000006 111.072 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 23.1 t -79.56 -36.61 38.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 62.399999999999999 110.837 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -72.95 -24.38 60.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.112 -0.495 . . . . 63.229999999999997 110.939 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.713 ' CD1' HD12 ' A' ' 127' ' ' LEU . 51.4 mt -101.81 -63.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 61.130000000000003 111.095 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.582 ' HB3' HG23 ' A' ' 113' ' ' THR . 8.3 m-85 -74.34 -60.68 2.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 75.430000000000007 110.826 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 110.26 49.37 0.72 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.701 -0.762 . . . . 44.310000000000002 112.438 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.88 -36.91 31.03 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.764 -0.731 . . . . 41.520000000000003 112.501 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLY . . . . . 0.412 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 102.82 165.08 26.03 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.771 -0.728 . . . . 71.530000000000001 112.522 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.49 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.8 p -50.93 -50.89 22.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.89 0.376 . . . . 62.219999999999999 111.12 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.49 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.7 OUTLIER -86.87 38.46 0.8 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.487 . . . . 71.140000000000001 110.89 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.412 ' HB2' ' O ' ' A' ' 95' ' ' GLY . . . -63.85 -76.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 55.140000000000001 111.097 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -43.02 -40.37 3.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 75.239999999999995 110.877 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.1 m -59.98 -75.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.145 -0.479 . . . . 74.310000000000002 110.857 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.63 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 32.5 mtt180 -50.03 -45.72 52.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.094 -0.503 . . . . 64.230000000000004 110.873 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.72 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.0 m-85 -55.41 -37.31 67.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.24 -0.436 . . . . 64.349999999999994 110.852 -179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -51.3 -30.11 17.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 74.530000000000001 110.928 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -106.96 -22.11 12.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.478 . . . . 61.219999999999999 110.889 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.69 26.75 9.57 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.784 -0.722 . . . . 73.049999999999997 112.539 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -98.06 -4.7 35.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.822 0.344 . . . . 71.230000000000004 110.83 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.63 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -112.11 8.7 20.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 22.02 111.041 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.558 ' HB2' HD11 ' A' ' 114' ' ' ILE . 2.0 pt20 -124.73 57.44 15.09 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.563 0.697 . . . . 71.140000000000001 110.855 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.53 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.9 Cg_endo -69.78 36.32 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.646 2.231 . . . . 64.450000000000003 112.342 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.772 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.5 t-160 73.93 32.28 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.522 0.677 . . . . 74.340000000000003 110.846 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.772 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 52.8 Cg_endo -69.86 -163.84 0.12 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.638 2.225 . . . . 74.129999999999995 112.316 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.44 -30.26 23.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.251 -0.432 . . . . 63.140000000000001 110.845 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.582 HG23 ' HB3' ' A' ' 92' ' ' PHE . 21.1 m -53.34 -50.57 64.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.138 -0.483 . . . . 73.420000000000002 111.141 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.558 HD11 ' HB2' ' A' ' 108' ' ' GLN . 41.0 mm -51.31 -42.36 26.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 62.530000000000001 111.136 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.555 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -68.17 -29.63 68.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.166 -0.47 . . . . 73.219999999999999 110.914 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.555 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.7 mp -79.25 -42.1 26.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 74.040000000000006 110.941 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.804 HD13 HG22 ' A' ' 74' ' ' ILE . 17.0 mt -63.93 -48.93 74.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 65.230000000000004 110.909 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.597 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.9 ptp180 -52.2 -34.81 47.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 60.539999999999999 110.882 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.597 HG13 ' HG3' ' A' ' 118' ' ' ARG . 30.9 m -93.88 -13.91 8.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.475 . . . . 73.219999999999999 111.144 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.82 HD12 HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -77.14 -40.29 46.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 72.209999999999994 110.9 179.954 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ASP . . . . . 0.596 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.5 OUTLIER -50.0 -31.23 12.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.187 -0.461 . . . . 72.409999999999997 110.822 179.88 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.35 -20.86 18.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 73.219999999999999 110.868 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.741 ' O ' HD13 ' A' ' 120' ' ' LEU . 53.7 m-70 -128.55 88.59 51.87 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.565 0.698 . . . . 61.530000000000001 110.835 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.704 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.9 Cg_endo -69.71 3.4 2.76 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.646 2.231 . . . . 63.340000000000003 112.367 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -117.83 -11.98 10.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.43 . . . . 74.540000000000006 110.912 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.527 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.5 tp -53.54 -47.99 69.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.199 -0.455 . . . . 71.219999999999999 110.976 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.713 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.9 pt? -46.32 -32.77 3.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.467 . . . . 64.0 110.871 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -81.87 -38.1 25.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.17 -0.468 . . . . 73.409999999999997 110.907 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.578 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -78.74 -6.18 55.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.458 . . . . 71.439999999999998 110.89 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.578 HG23 ' HG3' ' A' ' 129' ' ' GLU . 7.9 pt -119.17 -20.41 4.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 75.140000000000001 111.119 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.427 ' HG2' HG23 ' A' ' 91' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 65.420000000000002 110.892 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mtt . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.885 0.374 . . . . 71.030000000000001 110.88 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.02 -169.43 0.4 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 75.439999999999998 110.947 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.7 t -178.91 60.12 0.12 Allowed Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.588 0.709 . . . . 43.340000000000003 110.876 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -0.1 6.46 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 122.715 2.277 . . . . 71.420000000000002 112.324 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.628 HG21 ' OE1' ' A' ' 42' ' ' GLU . 27.8 m -87.52 -43.96 15.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.268 -0.424 . . . . 73.209999999999994 111.153 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.457 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -127.17 -30.8 2.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.474 . . . . 61.32 110.913 179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 22.1 m-70 69.79 68.91 0.23 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 72.329999999999998 110.897 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.414 ' NE2' ' HB3' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -132.52 -71.72 0.53 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 75.219999999999999 110.994 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.34 -129.99 6.84 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.71 -0.757 . . . . 52.109999999999999 112.482 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.459 ' O ' HG12 ' A' ' 12' ' ' VAL . 9.6 pt-20 -161.2 87.89 0.73 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.799 0.333 . . . . 70.420000000000002 110.88 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.561 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -50.64 105.04 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.146 -0.479 . . . . 75.519999999999996 110.874 179.951 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 10' ' ' GLU . 5.0 p -142.58 126.93 15.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 64.129999999999995 111.132 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.589 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.4 OUTLIER -49.51 129.28 18.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 73.310000000000002 110.791 -179.815 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.406 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 179.98 81.46 0.06 OUTLIER Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.72 -0.753 . . . . 74.040000000000006 112.46 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.414 HD12 ' N ' ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.02 146.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.912 0.386 . . . . 74.439999999999998 111.088 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.91 -165.4 1.62 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.12 -0.491 . . . . 73.340000000000003 110.854 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.654 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.6 OUTLIER -95.48 117.15 29.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 75.120000000000005 110.792 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.734 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.0 mm -107.88 91.53 7.77 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.623 0.725 . . . . 71.030000000000001 111.203 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.408 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.7 Cg_endo -69.72 96.48 0.59 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.678 2.252 . . . . 61.100000000000001 112.343 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.514 ' HB3' HG23 ' A' ' 27' ' ' THR . 16.6 t80 -61.15 -40.04 92.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 63.409999999999997 110.944 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.479 HG21 ' HG2' ' A' ' 25' ' ' ARG . 15.7 m -126.72 145.18 50.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.126 -0.488 . . . . 61.119999999999997 111.17 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -134.02 45.54 2.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 73.400000000000006 110.857 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.45 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -132.09 -68.4 0.63 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 71.450000000000003 110.911 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -136.08 -46.35 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.704 -0.76 . . . . 64.209999999999994 112.475 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.479 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.38 39.84 1.09 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.912 0.387 . . . . 74.319999999999993 110.918 -179.853 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -52.67 115.23 1.7 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.079 -0.51 . . . . 73.319999999999993 110.907 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.514 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -127.76 93.81 3.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 73.420000000000002 111.118 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.654 HG11 ' HB2' ' A' ' 17' ' ' ASP . 43.7 t -77.69 126.42 38.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 73.310000000000002 111.133 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.74 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.61 51.42 2.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 62.310000000000002 110.923 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.402 ' C ' ' O ' ' A' ' 29' ' ' LEU . 23.1 mttp -38.06 108.03 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 71.219999999999999 110.866 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.86 46.66 0.42 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.681 -0.771 . . . . 72.209999999999994 112.46 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.576 HD11 ' HB3' ' A' ' 29' ' ' LEU . 14.9 mm -107.61 91.22 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.838 0.352 . . . . 61.5 111.104 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.01 154.29 39.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.209 -0.451 . . . . 61.350000000000001 110.827 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.99 -108.57 0.31 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.709 -0.757 . . . . 52.539999999999999 112.491 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.757 HD12 ' HB ' ' A' ' 44' ' ' ILE . 49.9 mt -157.11 86.12 0.96 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.847 0.356 . . . . 71.400000000000006 110.874 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.402 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.02 161.08 33.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.151 -0.477 . . . . 74.140000000000001 110.905 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.6 t -169.58 -38.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.109 -0.496 . . . . 73.400000000000006 110.853 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.6 m -125.79 -47.18 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 53.439999999999998 111.153 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.88 170.43 10.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 71.530000000000001 110.892 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.9 t -137.4 15.91 2.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 74.129999999999995 110.863 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -104.82 -62.99 1.26 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 54.200000000000003 110.876 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.628 ' OE1' HG21 ' A' ' 5' ' ' VAL . 7.8 tp10 -77.15 61.93 2.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 65.019999999999996 110.897 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.6 p -97.09 154.21 17.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.088 -0.505 . . . . 74.120000000000005 110.891 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.757 ' HB ' HD12 ' A' ' 35' ' ' LEU . 20.1 mm -141.25 139.77 32.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 74.120000000000005 111.158 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.8 mtt -142.88 139.68 30.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.425 . . . . 73.230000000000004 110.852 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 41.1 m-20 -87.59 -169.94 2.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 64.129999999999995 110.885 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -61.03 2.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.191 -0.459 . . . . 53.329999999999998 110.843 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.48 -57.44 9.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 74.319999999999993 110.979 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.02 -58.15 6.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.031 -0.531 . . . . 70.329999999999998 110.84 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.5 t -53.49 -42.38 67.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 71.310000000000002 110.926 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.59 -44.0 85.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.093 -0.503 . . . . 72.140000000000001 110.936 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.77 -61.82 1.95 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 63.450000000000003 111.106 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.501 ' O ' HG13 ' A' ' 57' ' ' VAL . 18.1 t80 -52.6 -46.7 67.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.455 . . . . 75.510000000000005 110.859 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.44 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.41 -49.03 75.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.499 . . . . 72.25 110.91 179.98 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.94 -42.66 63.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.474 . . . . 62.539999999999999 111.135 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.74 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -69.65 -66.54 0.57 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 50.130000000000003 110.884 -179.944 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.501 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.3 m -47.24 -35.72 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 74.129999999999995 111.143 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.7 mmmt -69.07 -54.89 12.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 73.219999999999999 110.883 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.07 -53.58 19.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.246 -0.434 . . . . 72.219999999999999 111.063 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.701 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -62.88 -49.27 75.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.45 . . . . 72.140000000000001 110.868 -179.889 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.74 -36.31 25.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 72.019999999999996 110.823 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.65 -54.04 9.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.265 -0.425 . . . . 75.129999999999995 111.158 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.21 -28.27 64.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 54.299999999999997 110.884 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.701 HG22 ' O ' ' A' ' 60' ' ' PHE . 23.2 m -94.9 -17.29 7.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.095 -0.502 . . . . 72.400000000000006 111.166 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 74.219999999999999 110.862 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 7.1 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.777 0.322 . . . . 73.319999999999993 111.144 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.546 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.8 159.95 28.06 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.617 0.722 . . . . 43.119999999999997 111.104 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.574 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.4 Cg_endo -69.86 -7.48 21.2 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.658 2.239 . . . . 72.519999999999996 112.312 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -93.92 -37.44 11.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 71.530000000000001 110.856 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -57.76 -61.58 2.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.188 -0.46 . . . . 71.329999999999998 110.896 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.792 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.92 -67.33 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.154 -0.476 . . . . 74.209999999999994 111.106 -179.984 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -48.88 -39.49 11.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 71.120000000000005 111.09 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 22.5 mtmt -60.6 -46.17 91.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.459 . . . . 74.409999999999997 110.873 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.611 HG22 ' HB2' ' A' ' 121' ' ' ASP . 73.4 t -60.92 -39.3 81.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 74.5 111.094 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.441 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -63.91 -60.73 2.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.181 -0.463 . . . . 54.240000000000002 110.848 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -22.91 66.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 74.109999999999999 110.832 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -68.94 -54.04 17.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 71.230000000000004 110.884 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.701 HD22 ' HB3' ' A' ' 124' ' ' PRO . 9.2 mt -91.52 14.69 14.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.24 -0.436 . . . . 64.349999999999994 110.909 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 11.0 m 53.19 39.47 29.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 54.039999999999999 110.838 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.694 HD22 ' CE2' ' A' ' 92' ' ' PHE . 0.4 OUTLIER -79.69 88.17 5.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 70.209999999999994 110.958 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.676 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -46.73 156.87 0.17 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 63.520000000000003 111.197 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -59.67 -19.79 51.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 75.239999999999995 110.916 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 33.2 mmtt -82.45 -52.45 6.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.194 -0.457 . . . . 73.010000000000005 110.873 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.676 ' H ' HG23 ' A' ' 84' ' ' THR . 2.8 tt0 -61.75 -51.78 66.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 64.099999999999994 110.844 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.44 -34.2 56.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 73.150000000000006 111.101 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.4 t -80.14 -31.1 39.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.245 -0.434 . . . . 62.399999999999999 110.906 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -77.84 -25.64 48.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.097 -0.502 . . . . 63.229999999999997 110.838 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.701 ' CD1' HD12 ' A' ' 127' ' ' LEU . 47.7 mt -101.23 -59.73 3.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 61.130000000000003 111.121 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.694 ' CE2' HD22 ' A' ' 83' ' ' LEU . 7.7 m-85 -77.3 -61.12 2.09 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 75.430000000000007 110.898 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.78 50.07 0.71 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.767 -0.73 . . . . 44.310000000000002 112.486 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -78.77 -38.62 23.25 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 41.520000000000003 112.474 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLY . . . . . 0.407 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 104.79 166.41 24.28 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.738 -0.744 . . . . 71.530000000000001 112.471 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.496 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.9 p -51.76 -50.66 31.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.892 0.377 . . . . 62.219999999999999 111.101 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.496 ' N ' HG13 ' A' ' 96' ' ' VAL . 81.4 m-20 -86.91 38.65 0.81 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 71.140000000000001 110.917 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 95' ' ' GLY . . . -64.19 -76.46 0.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 55.140000000000001 111.08 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -43.33 -40.45 3.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.218 -0.446 . . . . 75.239999999999995 110.891 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.8 m -60.09 -75.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 74.310000000000002 110.874 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.626 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 30.9 mtt180 -49.84 -45.82 50.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 64.230000000000004 110.918 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.724 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.3 m-85 -55.65 -37.28 68.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.197 -0.456 . . . . 64.349999999999994 110.904 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -51.83 -29.69 20.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.493 . . . . 74.530000000000001 110.856 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.8 -22.29 12.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 61.219999999999999 110.94 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.65 26.9 9.45 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.782 -0.723 . . . . 73.049999999999997 112.504 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -98.19 -5.85 32.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.857 0.361 . . . . 71.230000000000004 110.889 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.626 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -110.83 9.22 22.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.136 -0.484 . . . . 22.02 111.07 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.551 ' HB2' HD11 ' A' ' 114' ' ' ILE . 2.0 pt20 -125.07 57.35 15.83 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.604 0.716 . . . . 71.140000000000001 110.835 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.532 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.0 Cg_endo -69.8 36.08 0.23 Allowed 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.656 2.238 . . . . 64.450000000000003 112.394 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.777 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 1.7 t-80 74.1 31.99 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.547 0.689 . . . . 74.340000000000003 110.849 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.777 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.6 Cg_endo -69.74 -163.83 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.71 2.273 . . . . 74.129999999999995 112.324 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 20.2 m -85.67 -29.58 23.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.445 . . . . 63.140000000000001 110.884 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.581 HG23 ' HB3' ' A' ' 92' ' ' PHE . 22.0 m -53.7 -50.84 65.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.113 -0.494 . . . . 73.420000000000002 111.14 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.551 HD11 ' HB2' ' A' ' 108' ' ' GLN . 39.3 mm -51.06 -42.61 24.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.249 -0.432 . . . . 62.530000000000001 111.094 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.534 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -68.08 -29.84 68.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 73.219999999999999 110.89 179.879 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.534 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.5 mp -78.82 -42.2 28.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.242 -0.435 . . . . 74.040000000000006 110.912 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.792 HD13 HG22 ' A' ' 74' ' ' ILE . 16.3 mt -64.06 -48.8 74.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 65.230000000000004 110.954 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.593 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.0 ptp180 -52.77 -34.63 54.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 60.539999999999999 110.918 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.593 HG13 ' HG3' ' A' ' 118' ' ' ARG . 29.3 m -93.66 -13.95 8.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 73.219999999999999 111.114 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.756 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -77.62 -40.2 42.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.111 -0.495 . . . . 72.209999999999994 110.899 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ASP . . . . . 0.611 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.5 OUTLIER -50.03 -31.1 12.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 72.409999999999997 110.852 179.932 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.51 -20.63 18.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.134 -0.485 . . . . 73.219999999999999 110.929 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.756 ' O ' HD13 ' A' ' 120' ' ' LEU . 50.3 m-70 -129.01 89.56 48.29 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.643 0.735 . . . . 61.530000000000001 110.854 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.701 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.2 Cg_endo -69.72 1.05 4.76 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.703 2.269 . . . . 63.340000000000003 112.334 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -114.53 -12.51 12.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 74.540000000000006 110.932 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.687 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.8 tp -53.85 -47.76 70.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.082 -0.508 . . . . 71.219999999999999 110.979 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.701 HD12 ' CD1' ' A' ' 91' ' ' ILE . 2.6 pt? -50.5 -29.21 9.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 64.0 110.955 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.474 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.59 -26.68 24.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.183 -0.462 . . . . 73.409999999999997 110.873 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.419 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.9 OUTLIER -95.52 4.1 53.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.446 . . . . 71.439999999999998 110.917 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.687 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.3 pt -123.16 -34.7 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 75.140000000000001 111.121 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.474 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 2.8 ptt-85 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 65.420000000000002 110.902 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 mmt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.864 0.364 . . . . 71.030000000000001 110.85 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.67 -168.81 0.39 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.272 -0.422 . . . . 75.439999999999998 110.877 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 p -179.45 61.18 0.12 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.579 0.704 . . . . 43.340000000000003 110.847 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.73 -5.41 16.12 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.706 2.271 . . . . 71.420000000000002 112.319 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.571 HG12 ' N ' ' A' ' 6' ' ' CYS . 1.7 t -72.0 -60.52 2.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 73.209999999999994 111.132 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.571 ' N ' HG12 ' A' ' 5' ' ' VAL . 0.5 OUTLIER -124.23 -17.91 6.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 61.32 110.906 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 63.85 72.57 0.46 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 72.329999999999998 110.87 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -131.29 -75.55 0.52 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.146 -0.479 . . . . 75.219999999999999 110.934 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -94.3 -117.22 2.85 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.727 -0.749 . . . . 52.109999999999999 112.515 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.438 ' HG2' HG22 ' A' ' 38' ' ' VAL . 7.0 pt-20 -170.84 93.94 0.19 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.86 0.362 . . . . 70.420000000000002 110.891 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.542 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -59.23 103.06 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.466 . . . . 75.519999999999996 110.852 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.7 p -144.28 129.32 14.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.282 -0.417 . . . . 64.129999999999995 111.169 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.603 ' N ' HD23 ' A' ' 35' ' ' LEU . 9.9 p -48.31 131.8 16.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.147 -0.479 . . . . 73.310000000000002 110.813 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.42 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.98 79.72 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.748 -0.739 . . . . 74.040000000000006 112.46 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.42 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.0 144.85 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.913 0.387 . . . . 74.439999999999998 111.115 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.08 -165.61 1.76 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.475 . . . . 73.340000000000003 110.889 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.69 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -94.62 116.91 29.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 75.120000000000005 110.911 179.867 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.745 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.9 mm -108.83 90.76 7.99 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.652 0.739 . . . . 71.030000000000001 111.134 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.525 ' HA ' HG22 ' A' ' 28' ' ' VAL . 54.3 Cg_endo -69.7 96.93 0.61 Allowed 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.72 2.28 . . . . 61.100000000000001 112.332 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -64.98 -36.41 84.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.294 -0.412 . . . . 63.409999999999997 110.861 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.55 HG21 ' HG2' ' A' ' 25' ' ' ARG . 58.7 m -128.2 151.64 49.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 61.119999999999997 111.162 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -152.27 41.69 0.64 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.438 . . . . 73.400000000000006 110.908 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.56 -39.61 1.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.132 -0.485 . . . . 71.450000000000003 110.887 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -158.53 -45.14 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.76 -0.734 . . . . 64.209999999999994 112.545 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.55 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -105.71 44.8 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.892 0.377 . . . . 74.319999999999993 110.915 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.484 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 0.5 OUTLIER -51.75 118.66 3.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 73.319999999999993 110.908 179.984 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.416 HG23 ' O ' ' A' ' 27' ' ' THR . 1.8 t -132.91 92.36 3.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.233 -0.439 . . . . 73.420000000000002 111.12 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.69 HG11 ' HB2' ' A' ' 17' ' ' ASP . 59.1 t -76.84 128.95 37.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 73.310000000000002 111.062 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.75 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.44 52.14 2.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 62.310000000000002 110.951 179.937 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.407 ' C ' ' O ' ' A' ' 29' ' ' LEU . 32.4 mttp -36.89 107.38 0.06 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 71.219999999999999 110.908 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.05 50.15 0.4 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.715 -0.755 . . . . 72.209999999999994 112.55 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.61 HD11 ' CB ' ' A' ' 29' ' ' LEU . 20.3 mm -108.89 93.14 2.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.836 0.351 . . . . 61.5 111.152 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -76.24 152.92 36.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.464 . . . . 61.350000000000001 110.817 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.96 -108.47 0.31 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.717 -0.754 . . . . 52.539999999999999 112.479 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.756 HD12 ' HB ' ' A' ' 44' ' ' ILE . 56.0 mt -156.92 85.98 0.97 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.816 0.341 . . . . 71.400000000000006 110.956 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.468 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.23 160.57 32.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 74.140000000000001 110.926 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.3 t -162.78 -41.0 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 73.400000000000006 110.885 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.438 HG22 ' HG2' ' A' ' 10' ' ' GLU . 4.3 m -127.99 -47.38 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.212 -0.449 . . . . 53.439999999999998 111.149 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.403 ' N ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -85.9 170.0 12.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.134 -0.484 . . . . 71.530000000000001 110.883 179.926 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -136.43 8.47 3.13 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.241 -0.436 . . . . 74.129999999999995 110.928 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -97.84 -63.45 1.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 54.200000000000003 110.896 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.442 ' OE1' HG11 ' A' ' 5' ' ' VAL . 6.1 tp10 -77.03 60.96 1.91 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 65.019999999999996 110.922 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.2 p -99.65 161.98 13.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 74.120000000000005 110.816 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.756 ' HB ' HD12 ' A' ' 35' ' ' LEU . 23.2 mm -144.22 140.21 24.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.091 -0.504 . . . . 74.120000000000005 111.055 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.6 mtm -144.89 129.98 18.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.138 -0.483 . . . . 73.230000000000004 110.92 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.7 m-20 -83.38 -169.79 2.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 64.129999999999995 110.877 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.62 -57.8 10.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 53.329999999999998 110.877 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -56.16 22.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.439 . . . . 74.319999999999993 110.905 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.64 -60.1 3.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.12 -0.491 . . . . 70.329999999999998 110.973 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.3 t -54.2 -39.38 66.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 71.310000000000002 110.834 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.44 -45.88 87.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.097 -0.501 . . . . 72.140000000000001 110.924 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.74 -59.29 4.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 63.450000000000003 111.1 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.438 ' O ' HG13 ' A' ' 57' ' ' VAL . 16.8 t80 -53.42 -48.37 68.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.226 -0.443 . . . . 75.510000000000005 110.861 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.432 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.93 -48.66 77.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 72.25 110.834 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.16 -41.28 62.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.288 -0.414 . . . . 62.539999999999999 111.109 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.75 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -70.6 -66.81 0.56 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.175 -0.466 . . . . 50.130000000000003 110.893 -179.938 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.467 HG12 HD21 ' A' ' 29' ' ' LEU . 13.5 m -47.28 -36.38 4.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.247 -0.433 . . . . 74.129999999999995 111.078 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -69.35 -52.94 22.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 73.219999999999999 110.865 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.56 -49.84 55.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.445 . . . . 72.219999999999999 111.122 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -65.86 -49.26 68.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.285 -0.416 . . . . 72.140000000000001 110.816 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -48.98 -44.03 40.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 72.019999999999996 110.834 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.88 -56.45 7.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 75.129999999999995 111.081 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -50.43 -43.3 54.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 54.299999999999997 110.882 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.0 p -77.84 -24.48 14.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.113 -0.494 . . . . 72.400000000000006 111.143 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.179 -0.464 . . . . 74.219999999999999 110.893 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 4.7 m . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.793 0.33 . . . . 73.319999999999993 111.144 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.54 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -104.56 159.59 28.82 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.598 0.713 . . . . 43.119999999999997 111.143 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.733 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.1 Cg_endo -69.77 -6.86 19.61 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.671 2.248 . . . . 72.519999999999996 112.385 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.93 -40.99 10.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 71.530000000000001 110.884 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -56.71 -61.13 2.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.476 . . . . 71.329999999999998 110.885 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.734 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.28 -68.87 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 74.209999999999994 111.176 179.943 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.1 m -48.73 -38.7 10.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.456 . . . . 71.120000000000005 111.109 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.1 mtmt -60.18 -40.17 89.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 74.409999999999997 110.845 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.526 HG22 ' HB2' ' A' ' 121' ' ' ASP . 82.3 t -69.58 -38.18 76.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 74.5 111.174 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -68.27 -35.39 77.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 54.240000000000002 110.882 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.0 pttt -88.06 -19.33 27.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.485 . . . . 74.109999999999999 110.923 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.431 ' HG2' HD23 ' A' ' 81' ' ' LEU . 0.7 OUTLIER -74.74 -51.73 13.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.446 . . . . 71.230000000000004 110.899 179.857 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.812 ' HB2' HD23 ' A' ' 83' ' ' LEU . 7.8 mt -92.21 14.58 15.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.449 . . . . 64.349999999999994 110.842 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.3 m 50.58 43.45 27.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 54.039999999999999 110.825 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.812 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.3 mm? -78.68 86.21 4.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.129 -0.487 . . . . 70.209999999999994 110.909 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.641 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.91 156.04 0.16 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.203 -0.453 . . . . 63.520000000000003 111.049 179.98 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -57.73 -22.49 46.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 75.239999999999995 110.881 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -79.85 -52.31 8.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 73.010000000000005 110.814 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.641 ' H ' HG23 ' A' ' 84' ' ' THR . 5.1 tp10 -62.67 -56.16 20.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.265 -0.425 . . . . 64.099999999999994 110.861 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.473 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -52.6 -34.32 50.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 73.150000000000006 111.127 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 91.9 p -80.95 -27.71 35.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.2 -0.454 . . . . 62.399999999999999 110.849 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -80.52 -26.66 37.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.48 . . . . 63.229999999999997 110.938 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.775 HD12 ' HB3' ' A' ' 131' ' ' ARG . 22.4 mm -101.29 -56.46 5.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.133 -0.485 . . . . 61.130000000000003 111.119 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.567 ' HB3' HG23 ' A' ' 113' ' ' THR . 4.7 m-85 -80.86 -62.93 1.52 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 75.430000000000007 110.933 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 110.95 52.38 0.57 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.692 -0.766 . . . . 44.310000000000002 112.469 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -80.71 -40.98 11.43 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.762 -0.733 . . . . 41.520000000000003 112.509 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 101.96 -179.87 27.55 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.746 -0.74 . . . . 71.530000000000001 112.513 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.528 HG13 ' N ' ' A' ' 97' ' ' ASN . 5.3 p -67.08 -50.55 62.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.822 0.344 . . . . 62.219999999999999 111.167 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.528 ' N ' HG13 ' A' ' 96' ' ' VAL . 8.9 p30 -86.24 31.9 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 71.140000000000001 110.937 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.63 -75.9 0.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 55.140000000000001 111.08 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -39.72 -47.34 2.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 75.239999999999995 110.87 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 40.2 t -56.92 -74.78 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 74.310000000000002 110.921 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.513 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 36.7 mtt180 -47.07 -54.48 10.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.124 -0.489 . . . . 64.230000000000004 110.87 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.616 ' HB3' HD12 ' A' ' 74' ' ' ILE . 13.2 m-85 -49.83 -37.68 31.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.45 . . . . 64.349999999999994 110.863 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -55.43 -40.65 71.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 74.530000000000001 110.904 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.26 -17.34 26.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 61.219999999999999 110.871 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.96 25.7 18.99 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.768 -0.729 . . . . 73.049999999999997 112.498 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -93.46 -27.66 16.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.831 0.348 . . . . 71.230000000000004 110.816 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.513 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -100.61 18.7 18.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 22.02 111.083 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.494 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -121.65 53.74 4.23 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.62 0.724 . . . . 71.140000000000001 110.889 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 54.0 Cg_endo -69.81 28.51 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.668 2.245 . . . . 64.450000000000003 112.347 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.718 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.5 m-70 70.2 36.87 0.12 Allowed Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.577 0.703 . . . . 74.340000000000003 110.88 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.718 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.5 Cg_endo -69.71 -165.37 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.64 2.227 . . . . 74.129999999999995 112.405 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.0 p -83.05 -32.64 26.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.267 -0.424 . . . . 63.140000000000001 110.913 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.567 HG23 ' HB3' ' A' ' 92' ' ' PHE . 18.5 m -49.17 -43.48 42.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.144 -0.48 . . . . 73.420000000000002 111.167 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.439 HD11 ' HG2' ' A' ' 108' ' ' GLN . 24.7 mm -58.96 -44.4 90.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 62.530000000000001 111.082 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.644 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -64.47 -28.85 69.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.466 . . . . 73.219999999999999 110.89 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.644 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.5 mp -81.14 -42.52 20.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.266 -0.424 . . . . 74.040000000000006 110.978 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.734 HD13 HG22 ' A' ' 74' ' ' ILE . 18.2 mt -61.54 -49.28 77.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 65.230000000000004 110.852 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.56 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.7 ptp180 -52.11 -39.41 59.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 60.539999999999999 110.864 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.56 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.8 m -88.34 -13.4 9.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.226 -0.443 . . . . 73.219999999999999 111.128 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.744 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -78.54 -39.88 36.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.162 -0.472 . . . . 72.209999999999994 110.923 179.979 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ASP . . . . . 0.526 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.4 OUTLIER -50.16 -31.33 13.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 72.409999999999997 110.881 179.857 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.43 -19.49 18.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.151 -0.477 . . . . 73.219999999999999 110.963 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.744 ' O ' HD13 ' A' ' 120' ' ' LEU . 46.5 m-70 -130.05 88.46 48.41 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.613 0.72 . . . . 61.530000000000001 110.867 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.658 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.4 Cg_endo -69.83 2.74 3.3 Favored 'Trans proline' 0 C--N 1.342 0.231 0 C-N-CA 122.652 2.235 . . . . 63.340000000000003 112.311 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -116.83 -11.68 10.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.274 -0.421 . . . . 74.540000000000006 110.837 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.668 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.4 tp -53.85 -46.38 71.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 71.219999999999999 110.883 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.523 HD13 HD11 ' A' ' 83' ' ' LEU . 1.6 pt? -50.11 -29.24 8.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 64.0 110.869 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.52 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 6.5 m120 -86.57 -27.48 23.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 73.409999999999997 110.928 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.426 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -94.54 4.58 53.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.19 -0.459 . . . . 71.439999999999998 110.919 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.668 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.0 pt -123.84 -35.1 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 75.140000000000001 111.146 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.775 ' HB3' HD12 ' A' ' 91' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 65.420000000000002 110.936 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 mmt . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.836 0.351 . . . . 71.030000000000001 110.849 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.56 -169.49 0.44 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.246 -0.434 . . . . 75.439999999999998 110.893 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 1.7 p 178.7 55.67 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.385 0 CA-C-O 121.516 0.674 . . . . 43.340000000000003 110.899 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 53.4 Cg_endo -69.79 -8.67 24.2 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.709 2.272 . . . . 71.420000000000002 112.277 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.665 HG21 ' CD ' ' A' ' 42' ' ' GLU . 6.8 m -67.45 -49.56 70.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 73.209999999999994 111.132 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.463 ' N ' HG23 ' A' ' 5' ' ' VAL . 1.2 m -133.19 -20.96 2.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.171 -0.468 . . . . 61.32 110.893 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 66.65 89.01 0.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.216 -0.447 . . . . 72.329999999999998 110.909 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.426 ' NE2' ' HB3' ' A' ' 6' ' ' CYS . 14.2 mp0 -132.26 -65.85 0.72 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 75.219999999999999 110.94 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.508 ' HA3' HG23 ' A' ' 38' ' ' VAL . . . -129.55 -96.0 0.78 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.745 -0.74 . . . . 52.109999999999999 112.441 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.589 ' HG2' HG22 ' A' ' 38' ' ' VAL . 8.6 pt-20 -177.0 95.28 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.87 0.367 . . . . 70.420000000000002 110.86 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.565 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -62.45 102.94 0.36 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 75.519999999999996 110.909 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.7 p -144.28 129.22 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.28 -0.418 . . . . 64.129999999999995 111.166 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.628 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -48.65 130.28 17.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.154 -0.476 . . . . 73.310000000000002 110.861 -179.793 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.421 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.66 80.71 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.752 -0.737 . . . . 74.040000000000006 112.487 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.421 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.3 146.21 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.851 0.358 . . . . 74.439999999999998 111.125 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.1 -165.49 1.73 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.123 -0.489 . . . . 73.340000000000003 110.914 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.654 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -95.62 117.76 31.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.265 -0.425 . . . . 75.120000000000005 110.846 179.912 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.73 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.4 mm -108.21 91.42 8.07 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.623 0.725 . . . . 71.030000000000001 111.13 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.438 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.7 Cg_endo -69.73 96.76 0.6 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.662 2.241 . . . . 61.100000000000001 112.322 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.483 ' HB3' HG23 ' A' ' 27' ' ' THR . 10.7 t80 -63.11 -37.69 88.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.198 -0.455 . . . . 63.409999999999997 110.882 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.478 HG23 ' HD3' ' A' ' 23' ' ' ARG . 11.0 m -127.55 146.97 50.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 61.119999999999997 111.153 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -142.86 38.5 1.47 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.46 . . . . 73.400000000000006 110.86 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.478 ' HD3' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -129.64 -40.42 1.4 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.192 -0.458 . . . . 71.450000000000003 110.854 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -156.41 -58.98 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.691 -0.766 . . . . 64.209999999999994 112.459 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.475 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -90.28 47.04 1.39 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.872 0.367 . . . . 74.319999999999993 110.926 -179.878 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.406 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 11.8 tttm -54.61 113.35 1.27 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 73.319999999999993 110.936 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.483 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.8 t -127.13 92.68 3.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.241 -0.436 . . . . 73.420000000000002 111.092 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.654 HG11 ' HB2' ' A' ' 17' ' ' ASP . 44.3 t -77.06 126.87 38.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 73.310000000000002 111.133 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.742 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.64 51.19 2.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 62.310000000000002 110.921 179.975 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.41 ' C ' ' O ' ' A' ' 29' ' ' LEU . 22.8 mttp -37.73 108.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.466 . . . . 71.219999999999999 110.851 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.48 47.02 0.43 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.716 -0.754 . . . . 72.209999999999994 112.473 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.566 HD11 ' HB3' ' A' ' 29' ' ' LEU . 15.5 mm -107.92 90.95 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.824 0.345 . . . . 61.5 111.168 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.54 153.97 40.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.195 -0.457 . . . . 61.350000000000001 110.865 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.46 -109.0 0.32 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.714 -0.755 . . . . 52.539999999999999 112.445 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.776 HD12 ' HB ' ' A' ' 44' ' ' ILE . 56.0 mt -156.79 86.29 0.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.857 0.36 . . . . 71.400000000000006 110.885 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.433 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.34 163.16 33.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 74.140000000000001 110.854 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.1 t -164.31 -39.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 73.400000000000006 110.967 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.589 HG22 ' HG2' ' A' ' 10' ' ' GLU . 15.7 m -131.1 -44.57 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.133 -0.485 . . . . 53.439999999999998 111.115 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.432 ' N ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -89.47 169.7 11.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 71.530000000000001 110.787 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 98.2 m -134.94 7.14 3.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.153 -0.476 . . . . 74.129999999999995 110.934 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -94.03 -65.07 1.01 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.176 -0.465 . . . . 54.200000000000003 110.895 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.665 ' CD ' HG21 ' A' ' 5' ' ' VAL . 16.0 tp10 -76.21 61.29 1.59 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.133 -0.485 . . . . 65.019999999999996 110.929 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.9 p -100.13 158.4 15.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 74.120000000000005 110.902 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.776 ' HB ' HD12 ' A' ' 35' ' ' LEU . 20.6 mm -145.33 140.17 22.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 74.120000000000005 111.133 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.5 mtt -143.37 140.55 30.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 73.230000000000004 110.848 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 35.5 m-20 -88.54 -169.88 2.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 64.129999999999995 110.861 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -61.13 2.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.179 -0.464 . . . . 53.329999999999998 110.867 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.26 -57.29 9.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 74.319999999999993 110.846 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.04 -58.25 6.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 70.329999999999998 110.866 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.8 t -53.48 -42.2 67.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 71.310000000000002 110.844 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -57.46 -45.02 85.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.146 -0.479 . . . . 72.140000000000001 110.866 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.03 -61.71 2.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 63.450000000000003 111.114 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.429 ' CZ ' HG11 ' A' ' 57' ' ' VAL . 15.8 t80 -52.6 -48.59 66.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 75.510000000000005 110.779 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.436 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -61.52 -48.9 78.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.245 -0.434 . . . . 72.25 110.878 179.959 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.79 -43.27 62.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.236 -0.438 . . . . 62.539999999999999 111.128 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.742 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -68.76 -66.6 0.55 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 50.130000000000003 110.945 -179.949 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.436 HG22 ' HA ' ' A' ' 54' ' ' MET . 15.0 m -47.5 -36.71 4.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.13 -0.486 . . . . 74.129999999999995 111.113 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 mmmt -67.02 -55.96 12.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 73.219999999999999 110.906 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.29 -53.05 23.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 72.219999999999999 111.145 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.613 ' O ' HG13 ' A' ' 64' ' ' VAL . 0.2 OUTLIER -62.85 -48.53 78.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 72.140000000000001 110.965 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -50.25 -38.47 40.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.126 -0.488 . . . . 72.019999999999996 110.855 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.67 -53.67 12.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.139 -0.482 . . . . 75.129999999999995 111.103 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.1 -26.95 63.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.152 -0.477 . . . . 54.299999999999997 110.864 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.613 HG13 ' O ' ' A' ' 60' ' ' PHE . 9.0 m -93.87 -19.56 6.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 72.400000000000006 111.109 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 74.219999999999999 110.887 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 16.8 m . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.855 0.359 . . . . 73.319999999999993 111.135 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.548 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -100.81 159.91 28.24 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.542 0.687 . . . . 43.119999999999997 111.132 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.74 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.3 Cg_endo -69.7 -6.78 19.4 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.657 2.238 . . . . 72.519999999999996 112.339 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -92.34 -40.24 11.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.271 -0.422 . . . . 71.530000000000001 110.841 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -57.77 -60.75 3.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 71.329999999999998 110.85 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.74 HD11 ' HA ' ' A' ' 71' ' ' PRO . 0.3 OUTLIER -44.18 -68.46 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.451 . . . . 74.209999999999994 111.126 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.3 m -49.03 -39.61 12.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 71.120000000000005 111.166 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.4 mtmt -59.42 -38.54 80.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 74.409999999999997 110.934 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.443 HG22 ' HB2' ' A' ' 121' ' ' ASP . 98.7 t -71.11 -39.22 73.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 74.5 111.089 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.8 OUTLIER -69.5 -30.59 68.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 54.240000000000002 110.918 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.64 -22.31 21.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.456 . . . . 74.109999999999999 110.853 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -74.14 -50.88 17.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 71.230000000000004 110.953 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.852 HD13 HD12 ' A' ' 120' ' ' LEU . 8.1 mt -90.64 12.68 18.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 64.349999999999994 110.865 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.43 43.01 29.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 54.039999999999999 110.853 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.836 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.3 mm? -78.69 86.28 4.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.125 -0.489 . . . . 70.209999999999994 110.91 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.624 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -46.11 156.75 0.14 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.16 -0.473 . . . . 63.520000000000003 111.103 179.911 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -59.89 -22.69 62.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 75.239999999999995 110.905 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.1 -51.06 10.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 73.010000000000005 110.887 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.624 ' H ' HG23 ' A' ' 84' ' ' THR . 0.9 OUTLIER -66.48 -52.75 42.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 64.099999999999994 110.843 -179.983 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.509 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -54.95 -32.01 61.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.113 -0.494 . . . . 73.150000000000006 111.103 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.4 t -80.44 -35.08 35.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 62.399999999999999 110.869 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -76.3 -23.37 54.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 63.229999999999997 110.878 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.732 ' CD1' HD12 ' A' ' 127' ' ' LEU . 57.1 mt -102.09 -60.68 2.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.142 -0.481 . . . . 61.130000000000003 111.16 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.56 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.8 m-85 -78.51 -63.49 1.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.485 . . . . 75.430000000000007 110.903 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 111.32 47.17 0.76 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.8 -0.715 . . . . 44.310000000000002 112.466 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -69.21 -46.88 56.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.721 -0.752 . . . . 41.520000000000003 112.488 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 111.45 169.53 18.75 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.689 -0.767 . . . . 71.530000000000001 112.48 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.682 HG13 ' H ' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -51.22 -66.6 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.912 0.387 . . . . 62.219999999999999 111.222 179.992 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.682 ' H ' HG13 ' A' ' 96' ' ' VAL . 31.6 m-80 -86.07 40.67 0.88 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.099 -0.5 . . . . 71.140000000000001 110.876 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.76 -73.6 0.1 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 55.140000000000001 111.095 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -40.28 -46.21 2.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.465 . . . . 75.239999999999995 110.912 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.3 m -56.46 -74.74 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.087 -0.506 . . . . 74.310000000000002 110.902 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.522 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 10.1 mtt85 -48.38 -52.79 20.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.08 -0.509 . . . . 64.230000000000004 110.867 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.615 ' HB3' HD12 ' A' ' 74' ' ' ILE . 12.0 m-85 -50.76 -36.27 35.91 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.216 -0.447 . . . . 64.349999999999994 110.925 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -56.12 -39.7 72.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 74.530000000000001 110.862 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.74 -17.64 23.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 61.219999999999999 110.948 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.0 27.15 14.33 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.747 -0.74 . . . . 73.049999999999997 112.502 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.1 m-20 -96.38 -20.57 18.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.794 0.331 . . . . 71.230000000000004 110.911 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.522 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -108.54 17.35 22.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.09 -0.505 . . . . 22.02 111.151 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.483 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.1 OUTLIER -120.56 54.56 3.7 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.63 0.729 . . . . 71.140000000000001 110.935 -179.949 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.429 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 54.1 Cg_endo -69.77 31.64 0.19 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.686 2.257 . . . . 64.450000000000003 112.361 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.696 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.0 m-70 69.02 38.46 0.18 Allowed Pre-proline 0 C--N 1.331 -0.237 0 CA-C-O 121.557 0.694 . . . . 74.340000000000003 110.854 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.696 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.5 Cg_endo -69.83 -165.71 0.16 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.619 2.212 . . . . 74.129999999999995 112.354 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 12.0 m -83.65 -33.54 25.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.237 -0.438 . . . . 63.140000000000001 110.904 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.56 HG23 ' HB3' ' A' ' 92' ' ' PHE . 15.5 m -48.87 -40.79 31.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.107 -0.497 . . . . 73.420000000000002 111.174 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.436 HD11 ' CG ' ' A' ' 108' ' ' GLN . 27.2 mm -61.08 -43.8 96.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 62.530000000000001 111.183 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.665 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -65.08 -28.91 69.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.084 -0.507 . . . . 73.219999999999999 110.843 179.867 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.665 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.5 mp -81.46 -42.98 19.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.231 -0.441 . . . . 74.040000000000006 110.911 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.614 HD13 HG22 ' A' ' 74' ' ' ILE . 30.2 mt -62.02 -49.36 76.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.185 -0.461 . . . . 65.230000000000004 110.856 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.577 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.6 ptp180 -51.61 -38.48 54.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 60.539999999999999 110.886 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.577 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.3 m -89.68 -13.99 9.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.169 -0.469 . . . . 73.219999999999999 111.134 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.852 HD12 HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -77.62 -40.82 40.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 72.209999999999994 110.89 -179.993 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ASP . . . . . 0.443 ' HB2' HG22 ' A' ' 77' ' ' VAL . 7.6 t70 -49.32 -31.98 10.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.199 -0.455 . . . . 72.409999999999997 110.926 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.46 -21.2 17.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.147 -0.479 . . . . 73.219999999999999 110.884 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.755 ' O ' HD13 ' A' ' 120' ' ' LEU . 38.8 m80 -127.56 88.21 54.2 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.606 0.717 . . . . 61.530000000000001 110.871 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.604 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.1 Cg_endo -69.74 3.53 2.71 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.716 2.277 . . . . 63.340000000000003 112.37 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -117.24 -12.69 10.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 74.540000000000006 110.937 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.663 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.2 tp -54.11 -46.79 72.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 71.219999999999999 110.954 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.732 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.41 -29.68 6.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.489 . . . . 64.0 110.903 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.511 HD21 HH12 ' A' ' 131' ' ' ARG . 6.3 m120 -86.27 -28.6 23.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 73.409999999999997 110.886 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.426 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -93.18 4.68 53.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.45 . . . . 71.439999999999998 110.91 -179.993 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.1 pt -123.81 -35.01 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 75.140000000000001 111.14 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.511 HH12 HD21 ' A' ' 128' ' ' ASN . 2.1 ptt-85 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 65.420000000000002 110.841 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.673 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 1.3 mmt . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.835 0.35 . . . . 71.030000000000001 110.871 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.82 -169.39 0.41 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 75.439999999999998 110.846 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.9 p 175.92 58.66 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.614 0.721 . . . . 43.340000000000003 110.924 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 1.15 4.67 Favored 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.698 2.265 . . . . 71.420000000000002 112.349 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.466 HG21 ' CB ' ' A' ' 42' ' ' GLU . 28.6 m -89.59 -41.97 14.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 73.209999999999994 111.213 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.438 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.7 OUTLIER -125.45 -31.37 3.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.152 -0.476 . . . . 61.32 110.896 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 66.6 53.42 0.93 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 72.329999999999998 110.85 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 85.7 mm-40 -112.38 -76.08 0.6 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.247 -0.433 . . . . 75.219999999999999 110.882 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.91 -109.47 3.27 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.702 -0.761 . . . . 52.109999999999999 112.449 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.673 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 7.6 pt-20 -177.46 98.3 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.888 0.375 . . . . 70.420000000000002 110.87 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.569 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -55.72 106.56 0.26 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.09 -0.505 . . . . 75.519999999999996 110.873 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.1 p -149.16 130.67 5.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 64.129999999999995 111.161 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.53 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -45.93 127.98 8.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.433 . . . . 73.310000000000002 110.893 -179.843 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.97 79.79 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.707 -0.758 . . . . 74.040000000000006 112.491 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.416 HD12 ' N ' ' A' ' 15' ' ' ILE . 0.7 OUTLIER -36.97 146.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.881 0.372 . . . . 74.439999999999998 111.092 -179.931 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.58 -168.28 2.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.187 -0.46 . . . . 73.340000000000003 110.909 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -93.98 116.21 28.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 75.120000000000005 110.889 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.776 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.2 mm -107.98 90.66 6.8 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.572 0.701 . . . . 71.030000000000001 111.157 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.514 ' HB3' HG12 ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.75 104.19 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.657 2.238 . . . . 61.100000000000001 112.383 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -70.87 -30.97 67.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 63.409999999999997 110.926 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.5 HG21 ' HG2' ' A' ' 25' ' ' ARG . 21.6 m -128.21 147.44 50.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 61.119999999999997 111.167 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -146.35 30.49 1.02 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 73.400000000000006 110.884 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.421 ' HD3' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -118.63 -44.81 2.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.116 -0.493 . . . . 71.450000000000003 110.878 -179.873 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -151.22 -58.08 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.774 -0.727 . . . . 64.209999999999994 112.473 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.5 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -91.73 45.46 1.23 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.381 . . . . 74.319999999999993 110.869 -179.835 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.402 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 9.1 tttm -49.66 110.85 0.42 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 73.319999999999993 110.872 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.637 HG21 ' CD1' ' A' ' 60' ' ' PHE . 2.2 t -132.13 93.28 3.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 73.420000000000002 111.131 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.514 HG12 ' HB3' ' A' ' 19' ' ' PRO . 0.8 OUTLIER -80.82 139.83 17.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 73.310000000000002 111.13 179.924 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.776 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -86.09 63.6 8.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 62.310000000000002 110.921 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.0 mttp -42.26 104.55 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 71.219999999999999 110.918 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.493 ' O ' HD13 ' A' ' 32' ' ' ILE . . . 117.42 60.49 0.3 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.759 -0.734 . . . . 72.209999999999994 112.495 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.593 HD11 ' CB ' ' A' ' 29' ' ' LEU . 18.2 mm -116.78 92.34 2.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.807 0.337 . . . . 61.5 111.135 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.52 156.66 36.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.274 -0.421 . . . . 61.350000000000001 110.828 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 164.53 -107.66 0.31 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.713 -0.755 . . . . 52.539999999999999 112.464 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.716 HD12 ' HB ' ' A' ' 44' ' ' ILE . 49.8 mt -156.47 83.33 0.98 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.91 0.385 . . . . 71.400000000000006 110.916 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.538 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -165.66 168.79 15.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 74.140000000000001 110.935 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.1 t -177.06 -35.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 73.400000000000006 110.879 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.69 -49.01 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 53.439999999999998 111.134 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.79 173.93 7.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 71.530000000000001 110.786 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.8 p -147.8 36.3 0.86 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 74.129999999999995 110.843 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -112.36 -75.67 0.6 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 54.200000000000003 110.913 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.466 ' CB ' HG21 ' A' ' 5' ' ' VAL . 1.8 pm0 -79.06 60.4 2.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 65.019999999999996 110.912 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.2 p -83.73 159.48 21.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.463 . . . . 74.120000000000005 110.837 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.716 ' HB ' HD12 ' A' ' 35' ' ' LEU . 28.4 mm -142.76 140.65 27.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.056 -0.52 . . . . 74.120000000000005 111.123 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.1 mtt -145.66 141.16 27.85 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 73.230000000000004 110.88 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.0 m-20 -86.07 -169.93 2.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 64.129999999999995 110.908 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 6.6 mmpt? -57.8 -59.62 4.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 53.329999999999998 110.878 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.93 -57.76 8.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.26 -0.427 . . . . 74.319999999999993 110.925 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.58 -59.03 4.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.19 -0.459 . . . . 70.329999999999998 110.882 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.6 t -52.79 -38.22 60.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.134 -0.485 . . . . 71.310000000000002 110.871 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.54 -43.24 99.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.096 -0.502 . . . . 72.140000000000001 110.902 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.89 -58.78 5.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 63.450000000000003 111.073 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.505 ' O ' HG13 ' A' ' 57' ' ' VAL . 15.1 t80 -53.63 -47.64 70.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.251 -0.431 . . . . 75.510000000000005 110.937 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -50.98 67.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.117 -0.492 . . . . 72.25 110.877 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.02 -40.57 58.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 62.539999999999999 111.071 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.736 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.7 OUTLIER -70.29 -67.48 0.49 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 50.130000000000003 110.876 -179.889 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.505 HG13 ' O ' ' A' ' 53' ' ' PHE . 9.3 m -48.01 -34.58 4.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.227 -0.442 . . . . 74.129999999999995 111.13 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.3 mmmm -69.19 -56.71 6.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 73.219999999999999 110.882 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -48.99 -51.89 28.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.248 -0.433 . . . . 72.219999999999999 111.07 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.693 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.2 OUTLIER -62.83 -48.66 78.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.263 -0.426 . . . . 72.140000000000001 110.853 -179.875 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.54 -37.57 40.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.494 . . . . 72.019999999999996 110.866 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.0 -52.82 15.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 75.129999999999995 111.133 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.46 -31.31 67.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 54.299999999999997 110.791 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.693 HG22 ' O ' ' A' ' 60' ' ' PHE . 30.9 m -91.45 -16.54 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 72.400000000000006 111.087 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 74.219999999999999 110.833 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 14.7 m . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.814 0.34 . . . . 73.319999999999993 111.166 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.543 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.71 159.39 30.03 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.535 0.684 . . . . 43.119999999999997 111.124 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.543 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 54.1 Cg_endo -69.73 -7.81 22.01 Favored 'Trans proline' 0 C--N 1.341 0.132 0 C-N-CA 122.681 2.254 . . . . 72.519999999999996 112.367 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -95.77 -38.36 10.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.23 -0.441 . . . . 71.530000000000001 110.917 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -55.71 -61.6 2.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.126 -0.488 . . . . 71.329999999999998 110.859 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.692 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.42 -68.68 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.165 -0.47 . . . . 74.209999999999994 111.094 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.6 m -48.88 -39.03 11.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 71.120000000000005 111.149 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -60.82 -38.52 85.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 74.409999999999997 110.966 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.479 HG22 ' HB2' ' A' ' 121' ' ' ASP . 97.3 t -70.63 -38.29 72.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.455 . . . . 74.5 111.111 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 78' ' ' ARG . 1.1 mtp180 -69.58 -32.63 71.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 54.240000000000002 110.85 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.57 -18.97 24.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 74.109999999999999 110.877 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.463 ' HG2' HD23 ' A' ' 81' ' ' LEU . 2.0 ttmt -76.1 -51.46 12.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.276 -0.42 . . . . 71.230000000000004 110.916 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.817 ' HB2' HD23 ' A' ' 83' ' ' LEU . 8.5 mt -91.39 14.44 14.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 64.349999999999994 110.905 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.49 42.91 29.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.464 . . . . 54.039999999999999 110.904 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.817 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.3 mm? -78.71 84.36 4.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 70.209999999999994 110.895 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.612 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.78 155.92 0.23 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 63.520000000000003 111.177 179.918 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -57.82 -22.52 47.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 75.239999999999995 110.936 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.17 -53.31 7.1 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.174 -0.467 . . . . 73.010000000000005 110.869 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.612 ' H ' HG23 ' A' ' 84' ' ' THR . 4.2 tp10 -64.42 -55.68 19.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 64.099999999999994 110.936 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.536 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -51.22 -35.9 39.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 73.150000000000006 111.094 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 94.5 p -78.61 -32.24 47.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 62.399999999999999 110.82 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -74.62 -28.52 60.92 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.123 -0.49 . . . . 63.229999999999997 110.906 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.778 HD12 ' HB3' ' A' ' 131' ' ' ARG . 17.3 mm -99.9 -61.75 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 61.130000000000003 111.11 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.537 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.3 m-85 -73.42 -63.46 1.19 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 75.430000000000007 110.882 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 117.51 37.94 0.88 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.765 -0.731 . . . . 44.310000000000002 112.549 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -57.54 -52.18 53.41 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.782 -0.723 . . . . 41.520000000000003 112.463 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.11 -154.49 16.62 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.698 -0.763 . . . . 71.530000000000001 112.556 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.6 t -85.14 -67.2 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.882 0.372 . . . . 62.219999999999999 111.065 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -82.11 36.18 0.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.443 . . . . 71.140000000000001 110.923 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.38 -78.77 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.5 . . . . 55.140000000000001 111.076 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -38.09 -43.05 0.71 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 75.239999999999995 110.913 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.2 t -57.39 -76.6 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 74.310000000000002 110.929 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.562 ' HB3' ' HB2' ' A' ' 107' ' ' ALA . 54.6 mtt180 -50.06 -48.97 52.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.481 . . . . 64.230000000000004 110.861 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.498 ' HB3' HD12 ' A' ' 74' ' ' ILE . 8.7 m-85 -52.22 -36.33 51.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.144 -0.48 . . . . 64.349999999999994 110.911 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -55.73 -31.67 62.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.065 -0.516 . . . . 74.530000000000001 110.876 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.44 -17.21 15.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 61.219999999999999 110.899 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.18 26.65 15.44 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.773 -0.727 . . . . 73.049999999999997 112.517 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -99.04 -2.82 36.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.848 0.356 . . . . 71.230000000000004 110.839 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.562 ' HB2' ' HB3' ' A' ' 101' ' ' ARG . . . -121.95 17.09 10.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 22.02 111.139 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.43 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 1.8 pt20 -126.34 55.21 13.0 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.535 0.684 . . . . 71.140000000000001 110.871 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.501 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.9 Cg_endo -69.74 39.09 0.27 Allowed 'Trans proline' 0 C--N 1.341 0.135 0 C-N-CA 122.619 2.213 . . . . 64.450000000000003 112.424 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.734 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.3 m170 70.96 35.31 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.618 0.723 . . . . 74.340000000000003 110.861 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.734 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.5 Cg_endo -69.69 -164.15 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.765 2.31 . . . . 74.129999999999995 112.348 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.29 -27.27 22.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 63.140000000000001 110.844 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.537 HG23 ' HB3' ' A' ' 92' ' ' PHE . 48.1 m -58.74 -41.28 86.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.078 -0.51 . . . . 73.420000000000002 111.161 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.402 HD11 ' HB2' ' A' ' 108' ' ' GLN . 46.3 mm -61.76 -46.31 96.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 62.530000000000001 111.13 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.445 ' HZ2' HG11 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -66.45 -29.05 69.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.136 -0.484 . . . . 73.219999999999999 110.911 179.869 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.458 ' CD2' HD12 ' A' ' 130' ' ' ILE . 5.7 mp -79.64 -42.35 25.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.192 -0.458 . . . . 74.040000000000006 110.845 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.692 HD13 HG22 ' A' ' 74' ' ' ILE . 26.9 mt -62.97 -48.57 78.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 65.230000000000004 110.931 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.592 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.3 ptp180 -53.05 -35.2 59.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 60.539999999999999 110.884 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.592 HG13 ' HG3' ' A' ' 118' ' ' ARG . 30.6 m -93.45 -12.8 8.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 73.219999999999999 111.066 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.744 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -79.02 -39.21 34.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 72.209999999999994 110.897 -179.989 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ASP . . . . . 0.479 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.6 OUTLIER -50.61 -30.39 13.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.244 -0.435 . . . . 72.409999999999997 110.801 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.15 -19.42 17.92 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.204 -0.453 . . . . 73.219999999999999 110.89 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.744 ' O ' HD13 ' A' ' 120' ' ' LEU . 46.5 m-70 -130.27 88.29 48.28 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.544 0.687 . . . . 61.530000000000001 110.837 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.651 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.3 Cg_endo -69.69 2.57 3.37 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.724 2.283 . . . . 63.340000000000003 112.351 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -116.81 -11.52 10.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.225 -0.443 . . . . 74.540000000000006 110.925 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.666 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.5 tp -53.87 -46.32 71.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.108 -0.496 . . . . 71.219999999999999 110.884 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.514 HD13 HD11 ' A' ' 83' ' ' LEU . 1.7 pt? -49.97 -29.65 8.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.471 . . . . 64.0 110.922 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.516 HD21 HH12 ' A' ' 131' ' ' ARG . 6.3 m120 -86.34 -27.8 24.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.448 . . . . 73.409999999999997 110.878 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.427 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -93.59 3.69 55.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.185 -0.461 . . . . 71.439999999999998 110.914 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.666 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.7 pt -122.6 -34.82 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.496 . . . . 75.140000000000001 111.124 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.778 ' HB3' HD12 ' A' ' 91' ' ' ILE . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 65.420000000000002 110.833 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.546 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 3.9 mmt . . . . . 0 N--CA 1.458 -0.063 0 CA-C-O 120.841 0.353 . . . . 71.030000000000001 110.88 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.7 -169.31 0.42 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 75.439999999999998 110.915 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 p 176.73 58.26 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.636 0.731 . . . . 43.340000000000003 110.91 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.82 3.66 2.67 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.653 2.235 . . . . 71.420000000000002 112.247 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.5 m -95.05 -42.46 12.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.293 -0.412 . . . . 73.209999999999994 111.131 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.62 -32.53 3.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 61.32 110.835 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.8 m-70 65.37 49.94 1.81 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.466 . . . . 72.329999999999998 110.828 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -111.18 -75.24 0.62 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.442 . . . . 75.219999999999999 110.819 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -102.08 -109.51 3.28 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.768 -0.729 . . . . 52.109999999999999 112.444 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.546 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 9.4 pt-20 -177.29 98.16 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.852 0.358 . . . . 70.420000000000002 110.854 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.573 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -55.78 105.85 0.21 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 75.519999999999996 110.845 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.1 p -148.28 129.93 6.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.169 -0.469 . . . . 64.129999999999995 111.141 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.548 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -45.69 125.28 5.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 73.310000000000002 110.891 -179.863 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -178.0 81.83 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.774 -0.727 . . . . 74.040000000000006 112.564 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.408 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -38.15 148.65 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.873 0.368 . . . . 74.439999999999998 111.12 -179.955 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.41 -164.84 1.44 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.189 -0.459 . . . . 73.340000000000003 110.907 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.664 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -97.2 116.75 29.97 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.243 -0.435 . . . . 75.120000000000005 110.867 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.727 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.2 mm -107.65 91.83 7.85 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.671 0.748 . . . . 71.030000000000001 111.086 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.423 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.6 Cg_endo -69.82 96.08 0.58 Allowed 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.693 2.262 . . . . 61.100000000000001 112.305 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.52 ' HB3' HG23 ' A' ' 27' ' ' THR . 16.3 t80 -60.76 -39.63 89.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.187 -0.461 . . . . 63.409999999999997 110.945 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.44 HG22 ' H ' ' A' ' 23' ' ' ARG . 15.7 m -128.41 144.69 51.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.134 -0.484 . . . . 61.119999999999997 111.064 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -134.13 45.81 2.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 73.400000000000006 110.864 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.44 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -132.57 -68.28 0.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 71.450000000000003 110.874 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.83 -46.62 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.712 -0.756 . . . . 64.209999999999994 112.513 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.435 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.25 39.71 1.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.86 0.362 . . . . 74.319999999999993 110.891 -179.885 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -52.51 118.92 3.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.161 -0.472 . . . . 73.319999999999993 110.909 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.52 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -132.55 93.31 3.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.254 -0.43 . . . . 73.420000000000002 111.15 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.664 HG11 ' HB2' ' A' ' 17' ' ' ASP . 42.9 t -77.45 126.2 37.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 73.310000000000002 111.105 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.743 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.33 51.77 2.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.108 -0.496 . . . . 62.310000000000002 110.89 -180.0 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -38.83 107.03 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 71.219999999999999 110.937 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.8 45.07 0.39 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.713 -0.756 . . . . 72.209999999999994 112.465 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.576 HD11 ' HB3' ' A' ' 29' ' ' LEU . 14.2 mm -106.28 91.0 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.862 0.363 . . . . 61.5 111.118 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.09 158.23 34.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.103 -0.499 . . . . 61.350000000000001 110.878 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 164.81 -106.86 0.28 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.762 -0.733 . . . . 52.539999999999999 112.497 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.743 HD12 ' HB ' ' A' ' 44' ' ' ILE . 45.6 mt -156.68 82.71 0.96 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.824 0.345 . . . . 71.400000000000006 110.924 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.482 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -165.04 168.25 17.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 74.140000000000001 110.893 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -175.47 -36.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 73.400000000000006 110.868 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.0 -49.06 2.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 53.439999999999998 111.108 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.73 175.55 7.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 71.530000000000001 110.883 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.8 t -148.73 35.69 0.78 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 74.129999999999995 110.881 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -111.84 -75.96 0.6 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.182 -0.463 . . . . 54.200000000000003 110.909 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -77.82 60.41 2.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 65.019999999999996 110.827 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.5 p -84.34 156.97 21.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.453 . . . . 74.120000000000005 110.84 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.743 ' HB ' HD12 ' A' ' 35' ' ' LEU . 26.6 mm -142.96 141.07 27.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 74.120000000000005 111.15 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 12.7 mtt -144.63 142.68 30.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.206 -0.452 . . . . 73.230000000000004 110.876 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.6 m-20 -88.04 -174.85 4.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.429 . . . . 64.129999999999995 110.858 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -59.65 4.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 53.329999999999998 110.872 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.66 -58.64 5.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.317 -0.401 . . . . 74.319999999999993 110.889 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -49.62 -54.17 19.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.491 . . . . 70.329999999999998 110.89 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.1 p -55.71 -44.0 77.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.101 -0.499 . . . . 71.310000000000002 110.845 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.74 -43.45 80.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 72.140000000000001 110.839 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.1 -63.0 1.21 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.165 -0.47 . . . . 63.450000000000003 111.118 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.491 ' O ' HG13 ' A' ' 57' ' ' VAL . 14.5 t80 -51.86 -46.1 64.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 75.510000000000005 110.895 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.425 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.69 -49.93 71.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.129 -0.487 . . . . 72.25 110.894 179.913 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.21 -42.38 60.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 62.539999999999999 111.059 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.743 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -69.87 -66.97 0.52 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.444 . . . . 50.130000000000003 110.889 -179.885 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.9 m -47.31 -35.56 3.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 74.129999999999995 111.143 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -69.18 -54.34 15.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 73.219999999999999 110.973 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.67 -53.71 22.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 72.219999999999999 111.09 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.641 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -62.84 -48.14 80.35 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 72.140000000000001 110.881 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.65 -36.72 36.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 72.019999999999996 110.886 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.46 -53.62 10.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 75.129999999999995 111.07 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.23 -26.66 65.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 54.299999999999997 110.9 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 60' ' ' PHE . 17.2 m -96.14 -16.27 7.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.487 . . . . 72.400000000000006 111.094 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 74.219999999999999 110.931 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 5.6 m . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.876 0.369 . . . . 73.319999999999993 111.103 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.4 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -101.21 154.88 36.92 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.575 0.702 . . . . 43.119999999999997 111.14 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.782 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.0 Cg_endo -69.77 -5.95 17.44 Favored 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.678 2.252 . . . . 72.519999999999996 112.332 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -93.67 -40.57 10.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.211 -0.45 . . . . 71.530000000000001 110.917 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.595 ' O ' HG23 ' A' ' 77' ' ' VAL . 19.6 t80 -57.06 -62.04 2.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 71.329999999999998 110.902 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.782 HD11 ' HA ' ' A' ' 71' ' ' PRO . 0.3 OUTLIER -39.8 -71.97 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 74.209999999999994 111.139 -179.981 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.402 HG23 ' N ' ' A' ' 76' ' ' LYS . 33.3 m -47.57 -38.73 6.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 71.120000000000005 111.142 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.402 ' N ' HG23 ' A' ' 75' ' ' VAL . 0.9 OUTLIER -62.82 -42.86 99.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 74.409999999999997 110.833 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.595 HG23 ' O ' ' A' ' 73' ' ' PHE . 25.3 t -62.78 -40.01 87.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 74.5 111.144 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.452 HH11 ' HD2' ' A' ' 78' ' ' ARG . 1.3 mtp85 -65.71 -55.03 19.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.444 . . . . 54.240000000000002 110.881 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.8 mmtp -66.48 -22.61 66.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 74.109999999999999 110.895 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -69.99 -52.98 19.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.464 . . . . 71.230000000000004 110.912 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.82 ' HB2' HD23 ' A' ' 83' ' ' LEU . 13.0 mt -89.84 13.63 14.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 64.349999999999994 110.908 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 53.65 38.7 28.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 54.039999999999999 110.831 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.82 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.6 mm? -78.73 81.75 5.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 70.209999999999994 110.919 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.562 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -44.57 156.79 0.07 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.214 -0.448 . . . . 63.520000000000003 111.122 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -54.18 -24.71 19.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.16 -0.473 . . . . 75.239999999999995 110.849 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.4 mtmt -79.14 -47.54 15.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.218 -0.446 . . . . 73.010000000000005 110.926 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.562 ' H ' HG23 ' A' ' 84' ' ' THR . 40.7 tt0 -65.28 -60.04 3.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.279 -0.419 . . . . 64.099999999999994 110.774 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.519 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -49.36 -34.92 17.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 73.150000000000006 111.085 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 84.9 p -77.78 -32.95 52.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 62.399999999999999 110.88 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -75.23 -29.98 60.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 63.229999999999997 110.882 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.735 HD12 ' CB ' ' A' ' 131' ' ' ARG . 17.8 mm -98.32 -63.08 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 61.130000000000003 111.1 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.562 ' HB3' HG23 ' A' ' 113' ' ' THR . 5.1 m-85 -73.11 -65.54 0.79 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.489 . . . . 75.430000000000007 110.896 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 125.21 32.6 0.78 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.719 -0.753 . . . . 44.310000000000002 112.459 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -51.92 -53.68 29.0 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.742 -0.742 . . . . 41.520000000000003 112.465 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 110.57 -136.23 13.44 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.687 -0.768 . . . . 71.530000000000001 112.506 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.24 -73.5 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.872 0.368 . . . . 62.219999999999999 111.127 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -85.64 42.66 0.98 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 71.140000000000001 110.889 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -59.7 -70.28 0.17 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.183 -0.462 . . . . 55.140000000000001 111.104 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -40.77 -48.78 3.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 75.239999999999995 110.88 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.7 m -55.13 -74.32 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 74.310000000000002 110.822 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.507 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 78.4 mtt180 -47.44 -55.17 9.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 64.230000000000004 110.865 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.651 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.0 m-85 -48.56 -36.57 15.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.178 -0.465 . . . . 64.349999999999994 110.917 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -57.1 -41.98 79.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.099 -0.5 . . . . 74.530000000000001 110.863 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.39 -15.66 30.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 61.219999999999999 110.868 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.42 25.64 23.01 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.735 -0.745 . . . . 73.049999999999997 112.519 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -93.68 -22.72 18.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 71.230000000000004 110.871 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.507 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -107.03 19.45 20.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.155 -0.475 . . . . 22.02 111.046 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.496 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.0 OUTLIER -121.23 53.42 3.57 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.652 0.739 . . . . 71.140000000000001 110.905 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.0 Cg_endo -69.8 28.49 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.683 2.256 . . . . 64.450000000000003 112.286 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.711 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.8 m-70 70.38 36.98 0.12 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.566 0.698 . . . . 74.340000000000003 110.838 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.711 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.7 Cg_endo -69.68 -165.27 0.15 Allowed 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.727 2.285 . . . . 74.129999999999995 112.369 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.7 p -82.04 -33.13 30.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.039 0.447 . . . . 63.140000000000001 110.88 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.587 HG22 ' CD1' ' A' ' 117' ' ' LEU . 23.0 m -49.25 -43.02 42.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.028 -0.533 . . . . 73.420000000000002 111.179 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.432 HD11 ' CG ' ' A' ' 108' ' ' GLN . 27.2 mm -60.82 -47.08 94.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 62.530000000000001 111.144 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.633 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -61.61 -27.7 68.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.145 -0.479 . . . . 73.219999999999999 110.942 179.901 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.633 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.4 mp -82.32 -45.64 14.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.203 -0.453 . . . . 74.040000000000006 110.848 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.78 HD13 HG22 ' A' ' 74' ' ' ILE . 14.5 mt -57.51 -46.89 83.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.44 . . . . 65.230000000000004 110.949 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.589 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.8 ptp180 -55.62 -35.08 65.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.488 . . . . 60.539999999999999 110.849 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.589 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.3 m -95.54 -5.37 10.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 73.219999999999999 111.157 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.742 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -88.84 -41.06 12.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.11 -0.496 . . . . 72.209999999999994 110.882 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -49.93 -31.82 13.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 72.409999999999997 110.876 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.11 -19.09 18.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 73.219999999999999 110.984 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.742 ' O ' HD13 ' A' ' 120' ' ' LEU . 47.7 m-70 -128.61 88.24 52.73 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.539 0.685 . . . . 61.530000000000001 110.83 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.581 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.7 Cg_endo -69.75 2.64 3.35 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.677 2.252 . . . . 63.340000000000003 112.357 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -115.73 -13.0 11.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.213 -0.448 . . . . 74.540000000000006 110.857 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.657 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.6 tp -54.49 -46.0 73.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.173 -0.467 . . . . 71.219999999999999 110.862 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.466 ' HB3' HD11 ' A' ' 120' ' ' LEU . 0.8 OUTLIER -49.18 -30.12 6.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 64.0 110.931 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.576 HD21 HH12 ' A' ' 131' ' ' ARG . 6.5 m120 -85.52 -29.93 23.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 73.409999999999997 110.935 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.422 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.0 OUTLIER -91.23 4.61 51.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 71.439999999999998 110.822 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.657 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.3 pt -124.06 -34.94 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.202 -0.453 . . . . 75.140000000000001 111.138 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.735 ' CB ' HD12 ' A' ' 91' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 65.420000000000002 110.84 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mtt . . . . . 0 C--O 1.23 0.043 0 CA-C-O 120.837 0.351 . . . . 71.030000000000001 110.927 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.4 -169.33 0.44 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 75.439999999999998 110.941 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.445 ' O ' ' N ' ' A' ' 7' ' ' HIS . 0.1 OUTLIER 174.88 57.99 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.569 0.7 . . . . 43.340000000000003 110.938 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.75 -0.59 7.13 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.649 2.232 . . . . 71.420000000000002 112.353 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.479 HG21 ' CD ' ' A' ' 42' ' ' GLU . 29.5 m -90.01 -44.33 14.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.435 . . . . 73.209999999999994 111.119 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.457 ' N ' HG23 ' A' ' 5' ' ' VAL . 14.2 p -119.51 -27.65 5.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 61.32 110.88 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.445 ' N ' ' O ' ' A' ' 3' ' ' CYS . 43.6 m-70 62.63 53.67 2.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 72.329999999999998 110.868 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -119.41 -75.16 0.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 75.219999999999999 110.956 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -98.87 -133.72 8.18 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.668 -0.777 . . . . 52.109999999999999 112.51 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.478 ' O ' HG12 ' A' ' 12' ' ' VAL . 6.1 pt-20 -156.06 87.41 1.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.863 0.363 . . . . 70.420000000000002 110.926 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.556 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -48.69 105.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 75.519999999999996 110.826 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.478 HG12 ' O ' ' A' ' 10' ' ' GLU . 4.2 p -141.85 126.48 16.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 64.129999999999995 111.163 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.587 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.3 p -49.27 131.71 19.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 73.310000000000002 110.908 -179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.411 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 177.98 80.66 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.805 -0.712 . . . . 74.040000000000006 112.481 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.411 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -37.08 146.9 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.882 0.372 . . . . 74.439999999999998 111.106 -179.985 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.24 -165.1 1.51 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 73.340000000000003 110.9 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.64 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -95.64 117.21 30.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.268 -0.424 . . . . 75.120000000000005 110.89 179.857 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.727 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.2 mm -107.79 91.23 7.22 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.62 0.724 . . . . 71.030000000000001 111.124 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 96.15 0.58 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.685 2.257 . . . . 61.100000000000001 112.364 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.549 ' HB3' HG23 ' A' ' 27' ' ' THR . 6.5 t80 -60.96 -35.83 77.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 63.409999999999997 110.934 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.435 HG21 ' HG2' ' A' ' 25' ' ' ARG . 6.4 m -132.37 144.38 50.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 61.119999999999997 111.187 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -133.58 45.77 2.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 73.400000000000006 110.915 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.416 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -132.45 -68.46 0.61 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.085 -0.507 . . . . 71.450000000000003 110.832 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.52 -47.31 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.749 -0.739 . . . . 64.209999999999994 112.529 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.435 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.24 40.8 1.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.797 0.332 . . . . 74.319999999999993 110.856 -179.893 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.2 tttm -53.92 117.64 3.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.189 -0.46 . . . . 73.319999999999993 110.92 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.549 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -130.07 92.85 3.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 73.420000000000002 111.134 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.64 HG11 ' HB2' ' A' ' 17' ' ' ASP . 40.7 t -77.31 125.88 37.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 73.310000000000002 111.115 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.734 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.84 51.55 2.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 62.310000000000002 110.889 179.979 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.9 mttm -37.94 108.06 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 71.219999999999999 110.923 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.66 47.08 0.42 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.738 -0.744 . . . . 72.209999999999994 112.527 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.581 HD11 ' HB3' ' A' ' 29' ' ' LEU . 14.8 mm -107.99 90.95 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.856 0.36 . . . . 61.5 111.113 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.89 154.14 39.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 61.350000000000001 110.839 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 168.25 -109.37 0.34 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.716 -0.754 . . . . 52.539999999999999 112.478 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.749 HD12 ' HB ' ' A' ' 44' ' ' ILE . 58.4 mt -156.89 86.86 0.98 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.815 0.34 . . . . 71.400000000000006 110.894 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -159.44 160.19 34.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 74.140000000000001 110.963 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 32.2 t -171.85 -39.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.162 -0.472 . . . . 73.400000000000006 110.918 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.409 HG13 ' N ' ' A' ' 39' ' ' HIS . 2.6 p -123.26 -46.6 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.121 -0.49 . . . . 53.439999999999998 111.045 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.409 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -91.82 171.03 9.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.23 -0.441 . . . . 71.530000000000001 110.846 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.84 19.8 2.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 74.129999999999995 110.892 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -110.27 -63.13 1.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.255 -0.43 . . . . 54.200000000000003 110.876 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.479 ' CD ' HG21 ' A' ' 5' ' ' VAL . 13.1 tp10 -76.87 61.94 2.0 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.124 -0.489 . . . . 65.019999999999996 110.914 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.7 p -95.42 154.81 17.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.078 -0.51 . . . . 74.120000000000005 110.846 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.749 ' HB ' HD12 ' A' ' 35' ' ' LEU . 18.2 mm -142.41 139.48 29.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 74.120000000000005 111.135 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.6 mtt -141.62 145.22 34.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 73.230000000000004 110.901 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.0 m-20 -90.55 -170.51 2.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 64.129999999999995 110.873 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.24 -61.08 2.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 53.329999999999998 110.853 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -51.49 -57.43 9.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 74.319999999999993 110.878 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.29 -58.67 5.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 70.329999999999998 110.875 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.7 t -52.18 -43.94 64.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 71.310000000000002 110.873 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.92 -44.02 81.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.119 -0.491 . . . . 72.140000000000001 110.895 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.46 -63.19 1.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 63.450000000000003 111.045 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.482 ' O ' HG13 ' A' ' 57' ' ' VAL . 14.4 t80 -51.63 -47.42 63.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.288 -0.414 . . . . 75.510000000000005 110.927 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.427 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.37 -49.37 75.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 72.25 110.844 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.52 -43.11 62.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.258 -0.428 . . . . 62.539999999999999 111.153 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.734 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -69.28 -66.73 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 50.130000000000003 110.875 -179.861 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.482 HG13 ' O ' ' A' ' 53' ' ' PHE . 11.4 m -47.27 -37.02 4.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.277 -0.42 . . . . 74.129999999999995 111.058 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -67.17 -54.79 17.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 73.219999999999999 110.829 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.32 -52.32 28.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.441 . . . . 72.219999999999999 111.084 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.718 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -64.83 -50.08 68.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.281 -0.418 . . . . 72.140000000000001 110.818 -179.912 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.41 -34.99 26.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 72.019999999999996 110.881 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.26 -56.19 5.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 75.129999999999995 111.066 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.89 -32.21 52.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 54.299999999999997 110.81 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.718 HG22 ' O ' ' A' ' 60' ' ' PHE . 34.3 m -89.03 -24.79 5.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.165 -0.47 . . . . 72.400000000000006 111.131 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.169 -0.469 . . . . 74.219999999999999 110.877 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 16.0 m . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.88 0.371 . . . . 73.319999999999993 111.159 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.567 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.2 160.15 27.21 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.535 0.683 . . . . 43.119999999999997 111.079 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.567 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.7 Cg_endo -69.79 -8.2 22.99 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.634 2.222 . . . . 72.519999999999996 112.324 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.41 -37.46 10.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 71.530000000000001 110.924 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -55.94 -59.42 4.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 71.329999999999998 110.835 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.748 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -46.27 -69.32 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.18 -0.464 . . . . 74.209999999999994 111.139 -179.973 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.3 m -47.54 -38.02 5.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 71.120000000000005 111.145 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -61.59 -45.2 95.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.485 . . . . 74.409999999999997 110.916 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.648 HG22 ' HB2' ' A' ' 121' ' ' ASP . 72.6 t -63.03 -38.92 83.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.444 . . . . 74.5 111.134 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.483 HH22 HG21 ' A' ' 113' ' ' THR . 0.1 OUTLIER -64.23 -54.79 27.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 54.240000000000002 110.892 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.99 -21.61 64.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 74.109999999999999 110.909 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -70.11 -53.69 16.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 71.230000000000004 110.896 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.824 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.6 mt -90.89 13.88 15.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 64.349999999999994 110.896 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 52.64 38.64 26.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 54.039999999999999 110.819 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.824 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.8 mm? -79.01 86.48 4.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.137 -0.483 . . . . 70.209999999999994 110.909 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.651 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.82 156.74 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 63.520000000000003 111.175 179.951 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -56.88 -22.07 34.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 75.239999999999995 110.937 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.63 -52.42 7.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 73.010000000000005 110.903 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.651 ' H ' HG23 ' A' ' 84' ' ' THR . 4.1 tp10 -58.93 -55.38 35.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 64.099999999999994 110.919 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.449 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -50.85 -31.64 17.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.49 . . . . 73.150000000000006 111.067 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 7.5 p -80.97 -32.13 34.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.435 . . . . 62.399999999999999 110.899 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.77 -21.82 54.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.075 -0.511 . . . . 63.229999999999997 110.887 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.751 HD12 ' HB3' ' A' ' 131' ' ' ARG . 22.4 mm -107.37 -61.71 2.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.47 . . . . 61.130000000000003 111.082 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.566 ' HB3' HG23 ' A' ' 113' ' ' THR . 4.5 m-85 -75.91 -64.04 1.17 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 75.430000000000007 110.852 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 116.49 49.21 0.44 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.763 -0.732 . . . . 44.310000000000002 112.443 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -72.03 -36.72 60.58 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.743 -0.741 . . . . 41.520000000000003 112.516 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.03 -123.52 7.15 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.727 -0.749 . . . . 71.530000000000001 112.474 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.489 HG22 ' N ' ' A' ' 97' ' ' ASN . 0.1 OUTLIER -120.46 -62.03 2.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 62.219999999999999 111.1 -179.986 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.489 ' N ' HG22 ' A' ' 96' ' ' VAL . 12.8 p30 -85.61 39.94 0.82 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 71.140000000000001 110.914 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.425 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -60.74 -77.54 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 55.140000000000001 111.068 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.425 ' C ' ' O ' ' A' ' 98' ' ' ALA . 54.7 m-85 -35.91 -46.74 0.48 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 75.239999999999995 110.884 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -57.35 -76.4 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 74.310000000000002 110.865 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.53 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 8.9 mtt180 -47.92 -52.73 18.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 64.230000000000004 110.865 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.632 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.6 m-85 -49.04 -38.62 24.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 64.349999999999994 110.949 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -52.79 -41.33 64.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.087 -0.506 . . . . 74.530000000000001 110.854 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.79 -17.24 24.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 61.219999999999999 110.977 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 94.08 25.51 16.78 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.757 -0.735 . . . . 73.049999999999997 112.505 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -92.89 -23.37 18.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.882 0.373 . . . . 71.230000000000004 110.938 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.53 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -103.86 17.22 24.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 22.02 111.079 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.499 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.9 OUTLIER -120.3 55.02 3.72 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.605 0.717 . . . . 71.140000000000001 110.98 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 54.1 Cg_endo -69.66 27.6 0.17 Allowed 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.633 2.222 . . . . 64.450000000000003 112.396 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.718 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.8 m-70 70.34 37.17 0.13 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.595 0.712 . . . . 74.340000000000003 110.869 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.718 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.5 Cg_endo -69.75 -165.25 0.15 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.67 2.247 . . . . 74.129999999999995 112.306 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 31.8 m -83.27 -33.44 26.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 63.140000000000001 110.818 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.566 HG23 ' HB3' ' A' ' 92' ' ' PHE . 23.9 m -49.09 -41.66 36.35 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.116 -0.493 . . . . 73.420000000000002 111.141 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.446 HD11 ' HG2' ' A' ' 108' ' ' GLN . 25.1 mm -60.6 -44.16 96.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.266 -0.425 . . . . 62.530000000000001 111.1 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.635 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -64.28 -29.18 70.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 73.219999999999999 110.927 179.87 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.635 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.4 mp -81.23 -43.24 19.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 74.040000000000006 110.937 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.748 HD13 HG22 ' A' ' 74' ' ' ILE . 18.5 mt -60.5 -49.06 79.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.228 -0.442 . . . . 65.230000000000004 110.939 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.565 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.2 ptp180 -52.86 -38.52 61.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 60.539999999999999 110.843 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.565 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.4 m -89.86 -11.08 10.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 73.219999999999999 111.094 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.768 HD12 HD13 ' A' ' 81' ' ' LEU . 0.5 OUTLIER -81.6 -39.87 23.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.206 -0.452 . . . . 72.209999999999994 110.925 179.927 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ASP . . . . . 0.648 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.4 OUTLIER -50.85 -30.38 14.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 72.409999999999997 110.832 179.9 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -98.3 -18.3 18.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 73.219999999999999 110.956 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.752 ' O ' HD13 ' A' ' 120' ' ' LEU . 59.7 m-70 -130.56 88.69 46.15 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.615 0.721 . . . . 61.530000000000001 110.879 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.695 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.2 Cg_endo -69.77 2.61 3.38 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.707 2.272 . . . . 63.340000000000003 112.367 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -116.44 -12.22 11.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 74.540000000000006 110.859 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.657 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.5 tp -54.22 -46.64 72.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 71.219999999999999 110.862 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.486 HD13 HD11 ' A' ' 83' ' ' LEU . 1.3 pt? -49.36 -29.59 6.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 64.0 110.901 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.49 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 6.5 m120 -86.16 -29.29 23.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.224 -0.444 . . . . 73.409999999999997 110.864 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.426 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -92.29 4.68 52.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 71.439999999999998 110.946 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.657 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.1 pt -124.04 -34.95 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.099 -0.501 . . . . 75.140000000000001 111.143 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.751 ' HB3' HD12 ' A' ' 91' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 65.420000000000002 110.899 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mmt . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.818 0.342 . . . . 71.030000000000001 110.822 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.78 -170.73 0.5 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 75.439999999999998 110.859 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 1.7 p 178.05 56.22 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.53 0.681 . . . . 43.340000000000003 110.794 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.405 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 55.2 Cg_endo -69.72 -8.83 24.6 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.699 2.266 . . . . 71.420000000000002 112.37 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.67 HG21 ' CD ' ' A' ' 42' ' ' GLU . 6.0 m -67.21 -49.98 67.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 73.209999999999994 111.115 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.464 ' N ' HG23 ' A' ' 5' ' ' VAL . 1.2 m -133.2 -21.1 2.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.093 -0.503 . . . . 61.32 110.845 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 66.91 88.96 0.1 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.253 -0.431 . . . . 72.329999999999998 110.87 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.428 ' NE2' ' HB3' ' A' ' 6' ' ' CYS . 14.1 mp0 -132.34 -66.57 0.69 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.249 -0.432 . . . . 75.219999999999999 110.933 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -127.37 -92.9 0.8 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.814 -0.707 . . . . 52.109999999999999 112.529 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 178.34 91.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.838 0.351 . . . . 70.420000000000002 110.845 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.57 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.0 OUTLIER -57.23 99.65 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 75.519999999999996 110.865 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -139.7 128.95 28.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 64.129999999999995 111.152 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.619 ' N ' HD23 ' A' ' 35' ' ' LEU . 42.3 m -48.87 130.44 18.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.182 -0.463 . . . . 73.310000000000002 110.852 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.404 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 177.49 82.13 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.658 -0.782 . . . . 74.040000000000006 112.471 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.428 HD12 ' N ' ' A' ' 15' ' ' ILE . 0.7 OUTLIER -37.59 147.17 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.881 0.372 . . . . 74.439999999999998 111.118 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.56 -168.61 2.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.454 . . . . 73.340000000000003 110.886 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.712 ' HB3' HG21 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -95.02 113.6 25.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 75.120000000000005 110.868 179.874 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.758 ' O ' HD22 ' A' ' 29' ' ' LEU . 5.7 mm -106.67 88.5 3.5 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.609 0.719 . . . . 71.030000000000001 111.125 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.526 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 54.1 Cg_endo -69.75 99.52 0.75 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.699 2.266 . . . . 61.100000000000001 112.374 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -65.07 -32.47 74.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.279 -0.419 . . . . 63.409999999999997 110.917 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.544 HG21 ' HG2' ' A' ' 25' ' ' ARG . 23.5 m -130.68 147.83 52.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.129 -0.487 . . . . 61.119999999999997 111.098 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -147.7 35.14 0.85 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 73.400000000000006 110.864 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.424 ' HD3' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -122.48 -43.0 2.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 71.450000000000003 110.926 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -154.56 -52.96 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.741 -0.742 . . . . 64.209999999999994 112.504 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.544 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -96.51 44.77 1.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.856 0.36 . . . . 74.319999999999993 110.886 -179.86 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.427 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 9.9 tttm -50.11 118.39 2.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 73.319999999999993 110.903 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.403 ' O ' HG23 ' A' ' 27' ' ' THR . 2.0 t -136.46 82.88 1.97 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 73.420000000000002 111.157 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.712 HG21 ' HB3' ' A' ' 17' ' ' ASP . 1.7 p -73.96 133.82 30.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.201 -0.454 . . . . 73.310000000000002 111.186 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.781 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.2 OUTLIER -84.41 53.73 2.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 62.310000000000002 110.894 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.403 ' C ' ' O ' ' A' ' 29' ' ' LEU . 13.8 mttm -37.07 105.88 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 71.219999999999999 110.895 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.47 50.8 0.36 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.736 -0.745 . . . . 72.209999999999994 112.527 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.647 HD11 ' CB ' ' A' ' 29' ' ' LEU . 22.9 mm -107.36 96.53 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.817 0.341 . . . . 61.5 111.115 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -77.57 153.26 33.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 61.350000000000001 110.825 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.19 -108.43 0.31 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.745 -0.74 . . . . 52.539999999999999 112.545 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.734 HD12 ' HB ' ' A' ' 44' ' ' ILE . 48.4 mt -156.88 85.8 0.97 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.858 0.361 . . . . 71.400000000000006 110.892 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.534 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -162.3 164.54 27.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 74.140000000000001 110.95 179.956 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 43.0 t -168.31 -38.76 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.145 -0.48 . . . . 73.400000000000006 110.9 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.1 m -128.44 -45.63 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 53.439999999999998 111.18 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.02 169.28 11.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 71.530000000000001 110.889 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 10.6 p -134.93 7.38 3.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.223 -0.444 . . . . 74.129999999999995 110.849 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -94.55 -65.02 1.01 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 54.200000000000003 110.921 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.67 ' CD ' HG21 ' A' ' 5' ' ' VAL . 13.4 tp10 -76.49 61.56 1.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.101 -0.5 . . . . 65.019999999999996 110.885 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.3 p -99.92 158.31 15.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.091 -0.504 . . . . 74.120000000000005 110.887 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.734 ' HB ' HD12 ' A' ' 35' ' ' LEU . 23.9 mm -142.37 140.18 29.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.491 . . . . 74.120000000000005 111.139 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.3 mtm -145.14 132.04 20.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 73.230000000000004 110.837 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 -84.91 -170.42 3.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.443 . . . . 64.129999999999995 110.845 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -55.22 32.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 53.329999999999998 110.985 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.38 -55.57 33.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.181 -0.463 . . . . 74.319999999999993 110.836 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -52.29 -60.83 2.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 70.329999999999998 110.892 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.7 t -54.71 -38.03 66.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 71.310000000000002 110.876 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -59.15 -45.7 90.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.126 -0.488 . . . . 72.140000000000001 110.869 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.48 -57.94 7.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 63.450000000000003 111.057 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.49 ' O ' HG13 ' A' ' 57' ' ' VAL . 14.1 t80 -54.16 -46.99 72.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 75.510000000000005 110.92 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.425 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -64.57 -50.27 67.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.14 -0.482 . . . . 72.25 110.879 179.976 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.22 -40.64 59.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 62.539999999999999 111.066 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.781 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -71.02 -67.51 0.5 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.452 . . . . 50.130000000000003 110.921 -179.924 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.556 HG12 HD21 ' A' ' 29' ' ' LEU . 12.4 m -47.24 -35.19 3.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.179 -0.464 . . . . 74.129999999999995 111.15 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -70.97 -51.26 26.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 73.219999999999999 110.897 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.77 -49.43 62.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.263 -0.426 . . . . 72.219999999999999 111.124 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.65 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.4 OUTLIER -67.0 -48.09 69.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 72.140000000000001 110.808 -179.913 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.12 -50.12 49.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 72.019999999999996 110.899 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.62 -54.37 32.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 75.129999999999995 111.066 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.87 -38.81 37.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 54.299999999999997 110.881 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 60' ' ' PHE . 37.2 t -81.86 -25.47 9.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 72.400000000000006 111.104 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.411 ' HB2' ' HA ' ' A' ' 109' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 74.219999999999999 110.852 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 11.5 m . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 120.824 0.345 . . . . 73.319999999999993 111.135 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.547 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -105.41 159.86 28.02 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.624 0.726 . . . . 43.119999999999997 111.101 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.594 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.8 Cg_endo -69.75 -7.14 20.31 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.678 2.252 . . . . 72.519999999999996 112.379 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.98 -37.98 11.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.219 -0.446 . . . . 71.530000000000001 110.892 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -57.51 -61.61 2.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 71.329999999999998 110.879 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.8 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.87 -67.32 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 74.209999999999994 111.099 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.0 m -49.3 -39.12 12.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 71.120000000000005 111.099 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -60.88 -45.72 93.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 74.409999999999997 110.898 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.538 HG22 ' HB2' ' A' ' 121' ' ' ASP . 76.7 t -61.33 -39.12 81.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 74.5 111.167 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.54 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -64.08 -59.34 4.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 54.240000000000002 110.915 179.993 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -22.72 67.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 74.109999999999999 110.926 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -69.21 -53.13 21.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 71.230000000000004 110.905 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.806 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.6 mt -90.69 12.95 17.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 64.349999999999994 110.931 179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 54.54 37.51 28.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.429 . . . . 54.039999999999999 110.871 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.806 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.8 mm? -80.02 87.11 5.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.109 -0.496 . . . . 70.209999999999994 110.899 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.648 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.77 157.17 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 63.520000000000003 111.142 179.961 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -57.6 -21.33 38.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 75.239999999999995 110.948 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.0 mmtp -81.3 -49.89 10.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.442 . . . . 73.010000000000005 110.914 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.648 ' H ' HG23 ' A' ' 84' ' ' THR . 7.2 tp10 -62.31 -52.36 63.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.436 . . . . 64.099999999999994 110.913 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.76 -36.49 67.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 73.150000000000006 111.084 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 30.6 t -79.18 -26.34 42.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 62.399999999999999 110.856 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -81.15 -27.69 35.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 63.229999999999997 110.883 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.732 HD12 ' HB3' ' A' ' 131' ' ' ARG . 26.5 mm -101.11 -59.09 3.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.116 -0.493 . . . . 61.130000000000003 111.172 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.596 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.7 m-85 -75.7 -61.29 1.97 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 75.430000000000007 110.878 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.32 48.98 0.78 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.754 -0.736 . . . . 44.310000000000002 112.471 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.61 -38.91 31.12 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.737 -0.744 . . . . 41.520000000000003 112.499 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 106.98 165.56 22.28 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.749 -0.738 . . . . 71.530000000000001 112.52 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.5 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.8 p -51.4 -51.39 24.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.896 0.379 . . . . 62.219999999999999 111.135 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.5 ' N ' HG13 ' A' ' 96' ' ' VAL . 9.0 t30 -87.24 39.17 0.85 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 71.140000000000001 110.866 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.7 -76.28 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 55.140000000000001 111.108 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -43.41 -39.72 3.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.439 . . . . 75.239999999999995 110.91 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 38.9 t -59.95 -75.57 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 74.310000000000002 110.818 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.624 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 36.2 mtt180 -50.61 -45.21 57.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 64.230000000000004 110.829 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.723 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.4 m-85 -56.25 -36.67 68.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.268 -0.423 . . . . 64.349999999999994 110.932 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -52.13 -28.99 19.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.122 -0.49 . . . . 74.530000000000001 110.854 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.77 -22.63 12.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.203 -0.453 . . . . 61.219999999999999 110.862 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.92 27.19 9.07 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.772 -0.727 . . . . 73.049999999999997 112.498 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -98.13 -6.62 31.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.791 0.329 . . . . 71.230000000000004 110.879 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.624 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -110.33 10.15 23.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 22.02 111.126 179.808 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.577 ' HB2' HD11 ' A' ' 114' ' ' ILE . 2.0 pt20 -125.14 57.27 15.79 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.598 0.714 . . . . 71.140000000000001 110.947 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.533 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.2 Cg_endo -69.82 36.68 0.24 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.671 2.247 . . . . 64.450000000000003 112.341 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.775 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.7 OUTLIER 73.9 32.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.554 0.693 . . . . 74.340000000000003 110.835 179.918 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.775 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.6 Cg_endo -69.74 -163.99 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.764 2.31 . . . . 74.129999999999995 112.322 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.4 p -86.65 -29.4 22.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.435 . . . . 63.140000000000001 110.84 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.599 HG22 HD12 ' A' ' 117' ' ' LEU . 34.5 m -53.41 -50.76 64.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.089 -0.505 . . . . 73.420000000000002 111.112 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.577 HD11 ' HB2' ' A' ' 108' ' ' GLN . 43.3 mm -51.34 -42.5 27.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.264 -0.425 . . . . 62.530000000000001 111.136 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.541 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -67.98 -29.86 69.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.225 -0.443 . . . . 73.219999999999999 110.868 179.838 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.541 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.7 mp -79.11 -41.64 28.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.277 -0.42 . . . . 74.040000000000006 110.886 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.8 HD13 HG22 ' A' ' 74' ' ' ILE . 14.8 mt -64.32 -49.27 72.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.149 -0.478 . . . . 65.230000000000004 110.962 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.595 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.3 ptp180 -51.92 -34.94 43.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 60.539999999999999 110.886 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.595 HG13 ' HG3' ' A' ' 118' ' ' ARG . 29.5 m -93.57 -14.74 8.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 73.219999999999999 111.194 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.769 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -76.05 -39.33 55.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 72.209999999999994 110.966 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ASP . . . . . 0.538 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.9 OUTLIER -50.67 -30.52 13.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.227 -0.442 . . . . 72.409999999999997 110.859 179.793 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -96.72 -20.01 18.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 73.219999999999999 110.886 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.769 ' O ' HD13 ' A' ' 120' ' ' LEU . 65.6 m-70 -131.21 90.05 39.76 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 121.619 0.723 . . . . 61.530000000000001 110.881 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.725 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.0 Cg_endo -69.69 -0.07 6.32 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.758 2.305 . . . . 63.340000000000003 112.345 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -113.48 -11.92 13.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.216 -0.447 . . . . 74.540000000000006 110.902 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.683 ' O ' HG23 ' A' ' 130' ' ' ILE . 6.3 tp -53.81 -47.78 70.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.149 -0.478 . . . . 71.219999999999999 110.845 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.739 HD13 HD11 ' A' ' 83' ' ' LEU . 2.1 pt? -51.1 -28.95 11.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 64.0 110.934 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.492 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.73 -26.05 24.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 73.409999999999997 110.869 179.929 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.411 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.0 OUTLIER -96.02 3.52 53.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 71.439999999999998 110.86 -179.978 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.683 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.7 pt -122.41 -34.49 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 75.140000000000001 111.207 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.732 ' HB3' HD12 ' A' ' 91' ' ' ILE . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 65.420000000000002 110.875 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.543 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 3.1 mmt . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.843 0.354 . . . . 71.030000000000001 110.919 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.7 -169.61 0.43 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.429 . . . . 75.439999999999998 110.903 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 p 176.92 57.84 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.677 0.751 . . . . 43.340000000000003 110.872 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 3.71 2.62 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.679 2.253 . . . . 71.420000000000002 112.332 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.2 m -95.66 -42.46 12.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 73.209999999999994 111.143 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.38 -32.69 3.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.15 -0.477 . . . . 61.32 110.831 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 65.35 51.02 1.64 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 72.329999999999998 110.851 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 94.8 mm-40 -114.59 -75.42 0.59 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 75.219999999999999 110.9 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -99.18 -112.43 3.3 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.79 -0.719 . . . . 52.109999999999999 112.526 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.543 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 8.0 pt-20 -175.81 97.12 0.07 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.81 0.338 . . . . 70.420000000000002 110.92 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.566 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.4 ptp -55.64 106.14 0.23 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 75.519999999999996 110.895 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.3 p -148.63 129.61 5.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.218 -0.446 . . . . 64.129999999999995 111.16 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.53 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -45.3 125.21 5.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 73.310000000000002 110.844 -179.84 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.9 82.17 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.759 -0.734 . . . . 74.040000000000006 112.488 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.407 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -38.34 148.87 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.864 0.364 . . . . 74.439999999999998 111.133 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.47 -164.74 1.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 73.340000000000003 110.9 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.657 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -97.4 116.66 30.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.211 -0.449 . . . . 75.120000000000005 110.871 179.86 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.722 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.4 mm -107.56 91.78 7.65 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.607 0.718 . . . . 71.030000000000001 111.158 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.422 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.6 Cg_endo -69.7 95.81 0.56 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.751 2.301 . . . . 61.100000000000001 112.379 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.504 ' HB3' HG23 ' A' ' 27' ' ' THR . 15.5 t80 -60.18 -40.39 89.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.0 0.428 . . . . 63.409999999999997 110.875 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.457 HG21 ' HG2' ' A' ' 25' ' ' ARG . 14.6 m -127.83 145.23 51.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 61.119999999999997 111.159 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -134.25 45.09 2.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 73.400000000000006 110.872 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.447 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -131.99 -68.44 0.63 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 71.450000000000003 110.865 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.35 -47.0 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.798 -0.715 . . . . 64.209999999999994 112.541 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.457 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.15 39.83 1.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.813 0.34 . . . . 74.319999999999993 110.852 -179.867 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.8 tttm -52.96 117.92 3.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 73.319999999999993 110.904 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.504 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.8 t -131.41 93.98 3.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 73.420000000000002 111.139 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.657 HG11 ' HB2' ' A' ' 17' ' ' ASP . 42.0 t -77.78 126.05 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.441 . . . . 73.310000000000002 111.147 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.722 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.3 OUTLIER -84.28 52.42 2.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.153 -0.476 . . . . 62.310000000000002 110.966 -179.989 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -39.19 106.92 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 71.219999999999999 110.901 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.88 45.6 0.37 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.698 -0.763 . . . . 72.209999999999994 112.437 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.57 HD11 ' HB3' ' A' ' 29' ' ' LEU . 14.3 mm -106.66 90.35 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.829 0.347 . . . . 61.5 111.118 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.54 158.57 34.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 61.350000000000001 110.888 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 164.42 -106.58 0.28 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.782 -0.723 . . . . 52.539999999999999 112.513 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.759 HD12 ' HB ' ' A' ' 44' ' ' ILE . 47.7 mt -156.63 82.65 0.96 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.839 0.352 . . . . 71.400000000000006 110.926 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.474 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -165.66 169.03 15.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.454 . . . . 74.140000000000001 110.932 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -176.6 -35.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 73.400000000000006 110.927 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -123.52 -45.94 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 53.439999999999998 111.071 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -95.33 176.44 6.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.128 -0.487 . . . . 71.530000000000001 110.844 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.4 p -148.54 30.71 0.82 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.19 -0.459 . . . . 74.129999999999995 110.885 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -105.14 -76.32 0.61 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 54.200000000000003 110.9 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -78.28 60.27 2.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 65.019999999999996 110.869 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.2 p -84.23 157.82 21.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 74.120000000000005 110.879 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.759 ' HB ' HD12 ' A' ' 35' ' ' LEU . 24.8 mm -143.81 140.91 25.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 74.120000000000005 111.139 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.7 mtt -143.8 145.43 32.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.066 -0.516 . . . . 73.230000000000004 110.857 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 41.7 m-20 -91.52 -169.97 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 64.129999999999995 110.83 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.69 -60.73 3.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 53.329999999999998 110.892 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -51.19 -57.41 8.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 74.319999999999993 110.908 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.02 -57.92 7.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.11 -0.496 . . . . 70.329999999999998 110.915 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.0 t -53.46 -42.17 66.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.124 -0.489 . . . . 71.310000000000002 110.853 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -57.6 -44.67 85.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 72.140000000000001 110.878 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.76 -61.51 2.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 63.450000000000003 111.155 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.494 ' O ' HG13 ' A' ' 57' ' ' VAL . 15.3 t80 -52.32 -47.29 66.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 75.510000000000005 110.848 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.426 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.2 -49.6 73.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 72.25 110.835 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.44 -42.27 61.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.256 -0.429 . . . . 62.539999999999999 111.127 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.717 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -69.96 -66.67 0.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 50.130000000000003 110.886 -179.886 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.494 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.0 m -47.45 -35.63 4.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.434 . . . . 74.129999999999995 111.167 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -69.04 -54.58 14.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 73.219999999999999 110.857 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.7 -54.35 19.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 72.219999999999999 111.105 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.551 ' O ' HG13 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -61.79 -48.91 78.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 72.140000000000001 110.928 -179.941 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.47 -39.44 33.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 72.019999999999996 110.839 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.52 -54.33 12.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 75.129999999999995 111.096 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.24 -31.39 63.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 54.299999999999997 110.826 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.551 HG13 ' O ' ' A' ' 60' ' ' PHE . 11.2 m -88.18 -22.51 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 72.400000000000006 111.175 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 74.219999999999999 110.859 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.444 HG21 HG23 ' A' ' 114' ' ' ILE . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.848 0.356 . . . . 73.319999999999993 111.091 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.414 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -78.99 155.63 77.43 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.621 0.724 . . . . 43.119999999999997 111.107 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.648 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.9 Cg_endo -69.62 -6.93 19.72 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.736 2.29 . . . . 72.519999999999996 112.347 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.17 -36.69 9.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 71.530000000000001 110.917 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.583 ' O ' HG23 ' A' ' 77' ' ' VAL . 21.7 t80 -59.06 -61.72 2.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.495 . . . . 71.329999999999998 110.856 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.844 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -39.43 -69.62 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 74.209999999999994 111.134 179.937 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.418 HG23 ' N ' ' A' ' 76' ' ' LYS . 35.7 m -49.54 -40.01 14.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.093 -0.503 . . . . 71.120000000000005 111.168 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.418 ' N ' HG23 ' A' ' 75' ' ' VAL . 25.2 mtmt -60.92 -45.12 95.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 74.409999999999997 110.933 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 73' ' ' PHE . 21.9 t -60.83 -39.79 83.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.146 -0.479 . . . . 74.5 111.086 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.464 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -63.98 -59.55 4.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 54.240000000000002 110.909 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt -63.05 -22.85 67.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 74.109999999999999 110.895 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -68.92 -52.95 24.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 71.230000000000004 110.84 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.693 HD22 ' HB3' ' A' ' 124' ' ' PRO . 11.7 mt -91.12 13.1 17.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.245 -0.434 . . . . 64.349999999999994 110.906 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.2 m 55.35 38.34 30.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.447 . . . . 54.039999999999999 110.837 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.686 HD21 HD13 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -79.54 86.67 5.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 70.209999999999994 110.92 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.637 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.53 157.23 0.15 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.482 . . . . 63.520000000000003 111.124 179.937 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -56.26 -21.74 25.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 75.239999999999995 110.911 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -81.97 -48.85 10.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.206 -0.452 . . . . 73.010000000000005 110.959 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.637 ' H ' HG23 ' A' ' 84' ' ' THR . 5.5 tp10 -61.89 -56.88 14.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 64.099999999999994 110.886 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.405 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -51.78 -38.04 53.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.169 -0.469 . . . . 73.150000000000006 111.099 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 27.0 t -77.69 -26.75 50.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 62.399999999999999 110.797 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -80.85 -29.21 35.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 63.229999999999997 110.868 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.768 HD12 ' HB3' ' A' ' 131' ' ' ARG . 18.2 mm -99.8 -60.95 2.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 61.130000000000003 111.106 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.608 ' HB3' HG23 ' A' ' 113' ' ' THR . 7.3 m-85 -72.69 -60.74 2.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 75.430000000000007 110.851 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 108.72 46.36 0.97 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.734 -0.746 . . . . 44.310000000000002 112.487 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -75.55 -43.78 23.15 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.722 -0.751 . . . . 41.520000000000003 112.562 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLY . . . . . 0.412 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 108.34 167.9 21.19 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.77 -0.729 . . . . 71.530000000000001 112.502 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.491 HG13 ' N ' ' A' ' 97' ' ' ASN . 3.1 p -52.33 -50.02 39.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.794 0.33 . . . . 62.219999999999999 111.172 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.491 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.9 OUTLIER -86.66 37.61 0.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.115 -0.493 . . . . 71.140000000000001 110.862 179.951 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.412 ' HB2' ' O ' ' A' ' 95' ' ' GLY . . . -64.6 -75.82 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.449 . . . . 55.140000000000001 111.044 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -44.42 -40.46 5.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.259 -0.428 . . . . 75.239999999999995 110.857 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.2 m -59.68 -74.76 0.07 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 74.310000000000002 110.838 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.617 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 16.3 mtt85 -50.19 -45.77 53.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.075 -0.511 . . . . 64.230000000000004 110.85 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.733 ' HB3' HD12 ' A' ' 74' ' ' ILE . 10.5 m-85 -56.09 -36.36 68.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.221 -0.445 . . . . 64.349999999999994 110.89 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -51.45 -29.23 15.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.473 . . . . 74.530000000000001 110.92 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -108.55 -23.02 12.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 61.219999999999999 110.921 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.09 26.54 8.8 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.723 -0.751 . . . . 73.049999999999997 112.438 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -96.99 -4.85 39.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.805 0.336 . . . . 71.230000000000004 110.888 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.617 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -112.58 8.4 19.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.216 -0.447 . . . . 22.02 111.144 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.515 ' HB2' HD11 ' A' ' 114' ' ' ILE . 2.1 pt20 -125.2 57.1 15.42 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.577 0.703 . . . . 71.140000000000001 110.87 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.54 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.2 Cg_endo -69.82 35.88 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.679 2.253 . . . . 64.450000000000003 112.279 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.786 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 1.1 t-80 74.79 31.28 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.644 0.735 . . . . 74.340000000000003 110.887 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.786 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.9 Cg_endo -69.78 -163.78 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.707 2.272 . . . . 74.129999999999995 112.306 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.14 -29.78 24.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.17 -0.468 . . . . 63.140000000000001 110.84 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.608 HG23 ' HB3' ' A' ' 92' ' ' PHE . 21.9 m -53.06 -52.18 59.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 73.420000000000002 111.134 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.515 HD11 ' HB2' ' A' ' 108' ' ' GLN . 38.8 mm -51.11 -45.14 30.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 62.530000000000001 111.183 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.449 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -65.35 -28.46 69.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 73.219999999999999 110.917 179.796 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.519 ' O ' HD23 ' A' ' 120' ' ' LEU . 5.9 mp -79.53 -42.92 24.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 74.040000000000006 110.905 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.844 HD13 HG22 ' A' ' 74' ' ' ILE . 7.3 mt -62.03 -47.64 83.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 65.230000000000004 110.898 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.587 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.3 ptp180 -54.74 -34.29 62.29 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.192 -0.458 . . . . 60.539999999999999 110.903 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.591 HG23 HD23 ' A' ' 126' ' ' LEU . 32.1 m -94.59 -10.13 9.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.164 -0.471 . . . . 73.219999999999999 111.083 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.759 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.6 OUTLIER -82.57 -40.19 21.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.197 -0.456 . . . . 72.209999999999994 110.924 179.907 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -49.54 -32.79 13.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.452 . . . . 72.409999999999997 110.882 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.52 -21.13 19.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 73.219999999999999 110.905 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.759 ' O ' HD13 ' A' ' 120' ' ' LEU . 66.5 m-70 -129.83 90.26 43.61 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.58 0.705 . . . . 61.530000000000001 110.911 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.693 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.6 Cg_endo -69.71 -0.72 7.28 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.674 2.25 . . . . 63.340000000000003 112.358 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -112.2 -12.39 13.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 74.540000000000006 110.792 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.689 ' O ' HG23 ' A' ' 130' ' ' ILE . 6.5 tp -53.79 -47.84 70.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.259 -0.428 . . . . 71.219999999999999 110.908 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.686 HD13 HD21 ' A' ' 83' ' ' LEU . 2.2 pt? -51.27 -28.67 12.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.212 -0.449 . . . . 64.0 110.905 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.488 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.87 -26.13 24.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 73.409999999999997 110.861 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.409 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.0 OUTLIER -95.78 2.99 54.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 71.439999999999998 110.912 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.689 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.1 pt -121.79 -34.55 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.138 -0.483 . . . . 75.140000000000001 111.117 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.768 ' HB3' HD12 ' A' ' 91' ' ' ILE . 1.7 ptt-85 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.14 -0.482 . . . . 65.420000000000002 110.851 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.603 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 6.2 mmt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.827 0.346 . . . . 71.030000000000001 110.818 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.65 -170.36 0.48 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 75.439999999999998 110.898 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.7 p 177.67 57.54 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.551 0.691 . . . . 43.340000000000003 110.92 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 3.58 2.66 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.672 2.248 . . . . 71.420000000000002 112.302 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 4.9 m -96.38 -42.69 12.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.289 -0.414 . . . . 73.209999999999994 111.172 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -120.54 -33.03 3.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.475 . . . . 61.32 110.922 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 65.29 51.46 1.59 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 72.329999999999998 110.906 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 95.5 mm-40 -118.2 -75.42 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 75.219999999999999 110.949 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.51 -115.63 2.96 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.688 -0.768 . . . . 52.109999999999999 112.475 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.603 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 6.3 pt-20 -174.88 95.38 0.08 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.837 0.351 . . . . 70.420000000000002 110.843 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.537 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.2 ptp -54.71 105.99 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.492 . . . . 75.519999999999996 110.847 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.4 HG12 ' O ' ' A' ' 10' ' ' GLU . 7.1 p -148.57 129.12 4.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 64.129999999999995 111.106 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.536 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -45.22 128.55 7.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.123 -0.49 . . . . 73.310000000000002 110.892 -179.87 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.401 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 179.88 80.0 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.791 -0.718 . . . . 74.040000000000006 112.509 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.402 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -36.8 145.9 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.876 0.369 . . . . 74.439999999999998 111.126 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.23 -167.9 2.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.183 -0.462 . . . . 73.340000000000003 110.933 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -94.39 116.18 28.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 75.120000000000005 110.861 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.757 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.3 mm -108.03 90.87 7.07 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.594 0.711 . . . . 71.030000000000001 111.128 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.49 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 53.0 Cg_endo -69.83 104.07 1.27 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.706 2.27 . . . . 61.100000000000001 112.286 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -71.49 -28.47 63.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.16 -0.473 . . . . 63.409999999999997 110.889 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.531 HG21 ' HG2' ' A' ' 25' ' ' ARG . 27.4 m -131.31 149.42 52.57 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.059 -0.519 . . . . 61.119999999999997 111.14 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.83 41.18 0.76 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.232 -0.44 . . . . 73.400000000000006 110.907 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -129.83 -48.45 1.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 71.450000000000003 110.927 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -146.34 -49.43 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.743 -0.741 . . . . 64.209999999999994 112.533 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.531 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -103.22 46.34 0.92 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.834 0.35 . . . . 74.319999999999993 110.797 -179.834 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.434 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 11.3 tttt -49.52 112.14 0.6 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.263 -0.426 . . . . 73.319999999999993 110.884 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.507 HG21 ' CG ' ' A' ' 60' ' ' PHE . 2.3 t -132.81 96.11 3.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.242 -0.436 . . . . 73.420000000000002 111.182 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.49 ' HA ' ' HA ' ' A' ' 19' ' ' PRO . 0.7 OUTLIER -84.65 140.34 16.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 73.310000000000002 111.164 179.928 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.757 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -86.58 63.7 8.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 62.310000000000002 110.929 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -42.36 104.39 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 71.219999999999999 110.913 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.49 ' O ' HD13 ' A' ' 32' ' ' ILE . . . 117.53 60.47 0.3 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.706 -0.759 . . . . 72.209999999999994 112.554 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.589 HD11 ' CB ' ' A' ' 29' ' ' LEU . 18.2 mm -116.63 93.05 2.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.856 0.36 . . . . 61.5 111.117 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.43 157.38 34.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 61.350000000000001 110.932 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 163.48 -106.77 0.28 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.769 -0.729 . . . . 52.539999999999999 112.533 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.747 HD12 ' HB ' ' A' ' 44' ' ' ILE . 49.6 mt -156.53 83.44 0.97 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.886 0.374 . . . . 71.400000000000006 110.966 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.57 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -167.64 169.5 11.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 74.140000000000001 110.994 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -178.88 -34.77 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.199 -0.455 . . . . 73.400000000000006 110.927 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.5 m -122.28 -44.99 2.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 53.439999999999998 111.138 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -98.53 177.45 5.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 71.530000000000001 110.862 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 29.0 p -148.47 26.51 0.94 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.209 -0.45 . . . . 74.129999999999995 110.911 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.8 mp0 -100.66 -76.75 0.55 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.138 -0.483 . . . . 54.200000000000003 110.859 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -78.38 59.54 2.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.076 -0.511 . . . . 65.019999999999996 110.923 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.2 p -84.39 159.25 20.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.072 -0.513 . . . . 74.120000000000005 110.82 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.747 ' HB ' HD12 ' A' ' 35' ' ' LEU . 28.2 mm -142.81 140.61 27.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.082 -0.508 . . . . 74.120000000000005 111.103 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.0 mtm -145.4 135.11 23.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 73.230000000000004 110.928 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -81.53 -170.08 2.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.294 -0.412 . . . . 64.129999999999995 110.879 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.34 -58.96 5.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 53.329999999999998 110.922 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -52.73 -56.99 11.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 74.319999999999993 110.843 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.75 -59.28 4.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 70.329999999999998 110.912 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.8 t -53.31 -38.27 63.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 71.310000000000002 110.864 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.69 -43.71 98.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 72.140000000000001 110.838 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.08 -57.5 8.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 63.450000000000003 111.008 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -55.01 -47.3 74.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.256 -0.429 . . . . 75.510000000000005 110.84 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.413 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.95 -48.87 74.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.213 -0.449 . . . . 72.25 110.916 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.97 -41.75 64.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 62.539999999999999 111.084 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.749 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.7 OUTLIER -69.52 -66.35 0.6 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 50.130000000000003 110.904 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.479 HG23 ' N ' ' A' ' 58' ' ' LYS . 27.2 m -47.4 -42.52 7.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 74.129999999999995 111.074 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.479 ' N ' HG23 ' A' ' 57' ' ' VAL . 3.7 mmtp -64.03 -50.76 67.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 73.219999999999999 110.836 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.53 -50.71 52.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 72.219999999999999 111.099 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.507 ' CG ' HG21 ' A' ' 27' ' ' THR . 0.3 OUTLIER -67.82 -43.95 78.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.233 -0.439 . . . . 72.140000000000001 110.924 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 36.5 mtp85 -51.04 -43.95 61.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 72.019999999999996 110.895 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.33 -55.42 8.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 75.129999999999995 111.097 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.83 -37.93 53.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 54.299999999999997 110.839 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.41 HG12 ' O ' ' A' ' 60' ' ' PHE . 5.2 p -84.86 -22.82 7.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 72.400000000000006 111.093 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 74.219999999999999 110.9 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.511 HG11 HG23 ' A' ' 74' ' ' ILE . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.858 0.361 . . . . 73.319999999999993 111.123 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.602 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -82.27 160.81 61.71 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.55 0.691 . . . . 43.119999999999997 111.071 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.602 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.4 Cg_endo -69.75 -7.63 21.55 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.632 2.222 . . . . 72.519999999999996 112.413 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -101.16 -36.28 9.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 71.530000000000001 110.919 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -56.6 -61.4 2.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 71.329999999999998 110.922 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.783 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.33 -68.7 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 74.209999999999994 111.089 179.944 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 28.1 m -48.53 -39.23 10.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 71.120000000000005 111.143 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.1 mtmt -60.68 -39.59 88.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 74.409999999999997 110.872 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.53 HG22 ' HB2' ' A' ' 121' ' ' ASP . 90.2 t -70.14 -36.91 70.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.189 -0.459 . . . . 74.5 111.126 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.3 OUTLIER -69.96 -34.27 73.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.192 -0.458 . . . . 54.240000000000002 110.917 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.7 ptpt -88.73 -19.78 25.65 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.181 -0.463 . . . . 74.109999999999999 110.861 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.469 ' HG2' HD23 ' A' ' 81' ' ' LEU . 3.1 ttmt -75.85 -50.63 14.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.258 -0.428 . . . . 71.230000000000004 110.87 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.824 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.1 mt -91.27 13.14 18.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.274 -0.421 . . . . 64.349999999999994 110.932 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 7.5 t 52.22 41.18 30.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 54.039999999999999 110.857 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.824 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.6 mm? -79.48 85.0 5.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 70.209999999999994 110.913 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.598 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -46.84 155.99 0.23 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 63.520000000000003 111.143 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -59.1 -20.62 55.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 75.239999999999995 110.902 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.01 -53.57 6.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 73.010000000000005 110.922 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.598 ' H ' HG23 ' A' ' 84' ' ' THR . 0.6 OUTLIER -65.9 -53.79 34.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 64.099999999999994 110.885 179.953 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.481 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -51.49 -31.87 25.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 73.150000000000006 111.046 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 44.4 t -80.24 -39.95 28.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.266 -0.425 . . . . 62.399999999999999 110.795 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -71.69 -20.89 61.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.473 . . . . 63.229999999999997 110.861 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.711 ' CD1' HD12 ' A' ' 127' ' ' LEU . 53.3 mt -104.31 -64.05 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 61.130000000000003 111.098 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.535 ' HB3' HG23 ' A' ' 113' ' ' THR . 8.7 m-85 -74.58 -61.15 1.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 75.430000000000007 110.834 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 113.09 47.96 0.63 Allowed Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.7 -0.762 . . . . 44.310000000000002 112.494 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.631 ' C ' ' HB2' ' A' ' 98' ' ' ALA . . . -68.04 -38.46 88.48 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.753 -0.737 . . . . 41.520000000000003 112.472 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 98.72 -164.94 20.98 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.768 -0.73 . . . . 71.530000000000001 112.489 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 5.2 t -71.41 -70.71 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.805 0.336 . . . . 62.219999999999999 111.107 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 26.1 t30 -84.87 39.41 0.75 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 71.140000000000001 110.847 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.631 ' HB2' ' C ' ' A' ' 94' ' ' GLY . . . -61.54 -71.69 0.14 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 55.140000000000001 111.016 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -41.15 -42.74 2.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 75.239999999999995 110.872 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.44 -74.72 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.162 -0.472 . . . . 74.310000000000002 110.86 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.606 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 10.0 mtt180 -48.27 -49.45 33.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.095 -0.502 . . . . 64.230000000000004 110.924 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.536 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.4 m-85 -53.8 -37.23 63.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 64.349999999999994 110.901 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -53.36 -34.65 58.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.135 -0.484 . . . . 74.530000000000001 110.88 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.61 -19.83 16.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 61.219999999999999 110.9 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.08 26.74 11.9 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.775 -0.726 . . . . 73.049999999999997 112.444 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -98.82 -6.16 29.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.882 0.372 . . . . 71.230000000000004 110.898 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.606 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -117.44 17.58 14.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.479 . . . . 22.02 111.099 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.429 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 1.9 pt20 -126.48 55.31 13.54 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.552 0.692 . . . . 71.140000000000001 110.944 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.497 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.0 Cg_endo -69.8 38.5 0.26 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.667 2.245 . . . . 64.450000000000003 112.37 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.732 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.7 t60 71.63 34.9 0.08 OUTLIER Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 121.604 0.716 . . . . 74.340000000000003 110.88 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.732 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.1 Cg_endo -69.82 -163.88 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.184 0 C-N-CA 122.714 2.276 . . . . 74.129999999999995 112.319 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 83.9 p -86.82 -29.56 22.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 63.140000000000001 110.889 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.535 HG23 ' HB3' ' A' ' 92' ' ' PHE . 18.8 m -56.25 -47.19 79.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.09 -0.505 . . . . 73.420000000000002 111.114 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.43 HG23 HG21 ' A' ' 69' ' ' VAL . 47.5 mm -56.29 -44.83 80.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 62.530000000000001 111.182 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.417 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -66.74 -28.97 68.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.108 -0.496 . . . . 73.219999999999999 110.892 179.845 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.52 ' CD2' HD12 ' A' ' 130' ' ' ILE . 5.6 mp -79.36 -42.12 26.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.259 -0.428 . . . . 74.040000000000006 110.945 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.783 HD13 HG22 ' A' ' 74' ' ' ILE . 19.3 mt -63.57 -48.84 75.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.241 -0.436 . . . . 65.230000000000004 110.917 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.593 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.3 ptp180 -52.61 -35.4 54.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 60.539999999999999 110.889 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.593 HG13 ' HG3' ' A' ' 118' ' ' ARG . 28.8 m -93.09 -13.36 8.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 73.219999999999999 111.11 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.747 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -78.05 -40.23 39.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 72.209999999999994 110.899 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ASP . . . . . 0.53 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.6 OUTLIER -49.95 -30.91 11.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.124 -0.489 . . . . 72.409999999999997 110.88 179.848 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.7 -20.3 17.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 73.219999999999999 110.895 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.747 ' O ' HD13 ' A' ' 120' ' ' LEU . 40.6 m-70 -127.98 87.73 54.89 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.557 0.694 . . . . 61.530000000000001 110.826 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.568 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.9 Cg_endo -69.78 3.42 2.79 Favored 'Trans proline' 0 N--CA 1.465 -0.174 0 C-N-CA 122.686 2.258 . . . . 63.340000000000003 112.384 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -117.19 -12.75 10.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 74.540000000000006 110.859 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.666 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.3 tp -53.95 -46.91 71.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 71.219999999999999 110.919 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.711 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.48 -29.64 6.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.476 . . . . 64.0 110.872 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.516 HD21 HH12 ' A' ' 131' ' ' ARG . 6.3 m120 -86.42 -28.37 23.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 73.409999999999997 110.891 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.423 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -93.29 4.36 54.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.185 -0.461 . . . . 71.439999999999998 110.855 179.996 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.666 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.0 pt -123.24 -35.03 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 75.140000000000001 111.163 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.516 HH12 HD21 ' A' ' 128' ' ' ASN . 1.8 ptt-85 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.481 . . . . 65.420000000000002 110.89 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 mmt . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.882 0.373 . . . . 71.030000000000001 110.874 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.35 -169.64 0.46 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.446 . . . . 75.439999999999998 110.92 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 1.7 p 178.78 55.74 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.592 0.71 . . . . 43.340000000000003 110.891 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 53.5 Cg_endo -69.77 -8.64 24.12 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.674 2.249 . . . . 71.420000000000002 112.346 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.664 HG21 ' CD ' ' A' ' 42' ' ' GLU . 6.8 m -67.49 -49.48 70.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.198 -0.455 . . . . 73.209999999999994 111.082 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.455 ' N ' HG23 ' A' ' 5' ' ' VAL . 1.2 m -133.3 -20.98 2.08 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.187 -0.461 . . . . 61.32 110.933 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 66.58 89.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 72.329999999999998 110.874 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.416 ' NE2' ' HB3' ' A' ' 6' ' ' CYS . 14.1 mp0 -132.14 -65.89 0.72 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 75.219999999999999 110.94 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.524 ' HA3' HG13 ' A' ' 38' ' ' VAL . . . -129.54 -95.4 0.77 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.739 -0.744 . . . . 52.109999999999999 112.464 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.586 ' HG2' HG12 ' A' ' 38' ' ' VAL . 7.1 pt-20 -177.67 95.3 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.805 0.336 . . . . 70.420000000000002 110.866 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.567 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -62.27 102.65 0.32 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 75.519999999999996 110.851 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.9 p -143.88 128.52 14.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 64.129999999999995 111.114 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.627 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -48.42 129.63 16.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 73.310000000000002 110.861 -179.829 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.404 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 178.05 81.15 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.74 -0.743 . . . . 74.040000000000006 112.545 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.408 HD12 ' N ' ' A' ' 15' ' ' ILE . 0.8 OUTLIER -36.8 146.22 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.843 0.354 . . . . 74.439999999999998 111.13 -179.951 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.32 -165.48 1.59 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.138 -0.483 . . . . 73.340000000000003 110.912 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.674 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.7 OUTLIER -94.24 118.21 31.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.305 -0.407 . . . . 75.120000000000005 110.92 179.85 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.746 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.1 mm -109.87 90.99 10.02 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.593 0.711 . . . . 71.030000000000001 111.158 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.455 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.2 Cg_endo -69.84 96.29 0.59 Allowed 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.704 2.269 . . . . 61.100000000000001 112.26 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -63.18 -36.44 83.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 63.409999999999997 110.964 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.534 HG21 ' HG2' ' A' ' 25' ' ' ARG . 58.8 m -129.33 151.43 49.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.109 -0.496 . . . . 61.119999999999997 111.117 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -146.1 40.37 1.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 73.400000000000006 110.869 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.461 ' H ' HG22 ' A' ' 21' ' ' THR . 5.7 mtt85 -125.21 -57.37 1.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 71.450000000000003 110.856 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -145.52 -39.21 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.803 -0.713 . . . . 64.209999999999994 112.501 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.534 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -105.19 40.8 1.45 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.826 0.346 . . . . 74.319999999999993 110.863 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.472 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 0.7 OUTLIER -51.03 115.16 1.4 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 73.319999999999993 110.9 179.924 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 27' ' ' THR . 1.8 t -128.98 94.87 3.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.254 -0.43 . . . . 73.420000000000002 111.154 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.674 HG11 ' HB2' ' A' ' 17' ' ' ASP . 48.3 t -78.3 127.61 38.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 73.310000000000002 111.13 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.746 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.3 OUTLIER -84.39 51.68 2.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.124 -0.489 . . . . 62.310000000000002 110.852 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 29' ' ' LEU . 35.5 mttp -37.4 107.51 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.256 -0.429 . . . . 71.219999999999999 110.871 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.19 48.11 0.4 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.743 -0.741 . . . . 72.209999999999994 112.506 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.6 HD11 ' HB3' ' A' ' 29' ' ' LEU . 18.7 mm -108.07 92.38 2.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.842 0.353 . . . . 61.5 111.181 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.8 153.52 38.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 61.350000000000001 110.863 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.64 -108.62 0.31 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.774 -0.727 . . . . 52.539999999999999 112.459 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.753 HD12 ' HB ' ' A' ' 44' ' ' ILE . 48.8 mt -156.74 86.24 0.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.879 0.371 . . . . 71.400000000000006 110.898 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.44 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.83 162.79 32.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 74.140000000000001 110.858 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.0 t -164.7 -39.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.082 -0.508 . . . . 73.400000000000006 110.924 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.586 HG12 ' HG2' ' A' ' 10' ' ' GLU . 5.5 p -129.86 -44.13 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 53.439999999999998 111.123 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.439 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -90.79 169.81 10.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.203 -0.453 . . . . 71.530000000000001 110.784 179.993 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.2 p -134.92 6.92 3.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.485 . . . . 74.129999999999995 110.931 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -93.73 -65.3 1.0 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.474 . . . . 54.200000000000003 110.904 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.664 ' CD ' HG21 ' A' ' 5' ' ' VAL . 16.1 tp10 -75.95 61.4 1.49 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 65.019999999999996 110.902 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.9 p -100.64 158.59 15.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 74.120000000000005 110.835 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.753 ' HB ' HD12 ' A' ' 35' ' ' LEU . 20.8 mm -142.81 140.01 27.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.149 -0.478 . . . . 74.120000000000005 111.114 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.7 mtt -143.75 133.88 24.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 73.230000000000004 110.889 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.3 m-20 -86.19 -169.87 2.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 64.129999999999995 110.869 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.87 -59.12 5.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 53.329999999999998 110.909 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -53.79 -56.53 16.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 74.319999999999993 110.926 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.29 -59.56 4.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.074 -0.512 . . . . 70.329999999999998 110.944 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.5 t -54.17 -39.38 66.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.486 . . . . 71.310000000000002 110.867 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.8 -45.47 89.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.128 -0.487 . . . . 72.140000000000001 110.857 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.81 -58.96 4.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.193 -0.458 . . . . 63.450000000000003 111.137 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.464 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.1 t80 -53.99 -47.8 71.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.189 -0.46 . . . . 75.510000000000005 110.899 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.408 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.28 -48.77 76.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.131 -0.486 . . . . 72.25 110.901 179.946 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.25 -41.77 63.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 62.539999999999999 111.05 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.741 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -70.19 -66.62 0.57 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 50.130000000000003 110.886 -179.877 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.464 HG13 ' O ' ' A' ' 53' ' ' PHE . 13.5 m -47.32 -35.3 3.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 74.129999999999995 111.164 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.3 mmmt -70.29 -52.35 23.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 73.219999999999999 110.888 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.48 -50.77 59.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.251 -0.431 . . . . 72.219999999999999 111.138 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.65 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -65.14 -47.63 76.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.438 . . . . 72.140000000000001 110.834 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.11 -51.75 40.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.132 -0.485 . . . . 72.019999999999996 110.895 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.78 -54.76 34.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 75.129999999999995 111.08 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.19 -42.53 40.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 54.299999999999997 110.796 -179.712 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 60' ' ' PHE . 37.5 t -76.56 -27.32 17.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.435 . . . . 72.400000000000006 111.143 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 74.219999999999999 110.916 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.401 HG21 HD12 ' A' ' 114' ' ' ILE . 17.2 m . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.889 0.376 . . . . 73.319999999999993 111.126 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.464 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.3 156.93 36.08 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.589 0.709 . . . . 43.119999999999997 111.131 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.48 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.3 Cg_endo -69.83 -7.95 22.38 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.699 2.266 . . . . 72.519999999999996 112.314 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.32 -34.68 10.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.446 . . . . 71.530000000000001 110.822 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.404 ' CE1' ' HA ' ' A' ' 118' ' ' ARG . 12.9 t80 -58.93 -61.15 2.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 71.329999999999998 110.864 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.841 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -43.91 -66.39 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.209999999999994 111.145 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.1 m -50.95 -38.64 18.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 71.120000000000005 111.068 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt -59.54 -47.8 84.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 74.409999999999997 110.912 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.5 t -60.78 -39.54 82.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.152 -0.476 . . . . 74.5 111.094 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.2 OUTLIER -62.14 -58.77 6.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 54.240000000000002 110.86 -179.936 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -19.97 65.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 74.109999999999999 110.865 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.3 ttmm -69.33 -55.83 9.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 71.230000000000004 110.853 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.716 HD13 HD12 ' A' ' 120' ' ' LEU . 7.1 mt -91.39 15.12 12.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.267 -0.424 . . . . 64.349999999999994 110.914 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 53.4 39.26 29.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 54.039999999999999 110.832 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.701 HD22 ' CE2' ' A' ' 92' ' ' PHE . 0.4 OUTLIER -79.84 87.09 5.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.137 -0.483 . . . . 70.209999999999994 110.921 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.598 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.39 156.74 0.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.162 -0.472 . . . . 63.520000000000003 111.178 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -58.78 -21.47 55.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 75.239999999999995 110.902 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.47 -54.19 6.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 73.010000000000005 110.917 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.598 ' H ' HG23 ' A' ' 84' ' ' THR . 0.7 OUTLIER -61.48 -53.15 60.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 64.099999999999994 110.921 179.897 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.42 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -51.57 -32.46 28.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.083 -0.508 . . . . 73.150000000000006 111.077 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 4.3 m -80.72 -34.44 34.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.296 -0.411 . . . . 62.399999999999999 110.856 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -76.26 -21.61 56.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.101 -0.499 . . . . 63.229999999999997 110.868 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.742 ' CD1' HD12 ' A' ' 127' ' ' LEU . 40.6 mt -105.65 -62.22 2.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.446 . . . . 61.130000000000003 111.113 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.701 ' CE2' HD22 ' A' ' 83' ' ' LEU . 5.4 m-85 -75.69 -63.22 1.35 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 75.430000000000007 110.897 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 115.54 48.72 0.5 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.736 -0.745 . . . . 44.310000000000002 112.516 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -70.37 -37.06 70.15 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.738 -0.744 . . . . 41.520000000000003 112.453 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 103.87 -160.0 16.37 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.743 -0.742 . . . . 71.530000000000001 112.464 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.8 t -76.7 -69.93 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.927 0.394 . . . . 62.219999999999999 111.14 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -85.37 44.09 1.07 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.467 . . . . 71.140000000000001 110.893 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -59.05 -75.58 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 55.140000000000001 111.09 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.403 ' C ' ' O ' ' A' ' 98' ' ' ALA . 36.6 m-85 -37.75 -43.26 0.64 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.216 -0.447 . . . . 75.239999999999995 110.924 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.2 t -58.31 -75.86 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 74.310000000000002 110.859 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.617 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 20.9 mtt180 -49.45 -49.24 46.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 64.230000000000004 110.851 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.595 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.4 m-85 -53.0 -36.21 60.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 64.349999999999994 110.916 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -52.72 -36.29 57.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 74.530000000000001 110.856 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.79 -19.6 16.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 61.219999999999999 110.903 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.78 24.46 13.35 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.768 -0.73 . . . . 73.049999999999997 112.507 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 29.3 m120 -95.58 -5.78 41.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.803 0.335 . . . . 71.230000000000004 110.876 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.617 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -115.02 17.43 16.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 22.02 111.133 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.566 ' HB2' HD11 ' A' ' 114' ' ' ILE . 1.8 pt20 -129.49 56.03 21.86 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.603 0.716 . . . . 71.140000000000001 110.889 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.514 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.6 Cg_endo -69.75 38.67 0.26 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.734 2.289 . . . . 64.450000000000003 112.339 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.745 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER 72.05 34.21 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.547 0.689 . . . . 74.340000000000003 110.849 179.971 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.745 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.1 Cg_endo -69.81 -164.5 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.632 2.222 . . . . 74.129999999999995 112.34 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 4.1 p -88.94 -27.15 21.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.138 -0.483 . . . . 63.140000000000001 110.932 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.569 HG23 ' HB3' ' A' ' 92' ' ' PHE . 8.3 m -56.94 -49.85 74.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.058 -0.519 . . . . 73.420000000000002 111.121 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.566 HD11 ' HB2' ' A' ' 108' ' ' GLN . 36.5 mm -47.5 -45.75 10.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 62.530000000000001 111.169 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.708 ' HD3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -65.39 -46.98 77.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.475 . . . . 73.219999999999999 110.818 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.708 HD12 ' HD3' ' A' ' 115' ' ' LYS . 7.8 mp -60.16 -34.15 73.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.273 -0.421 . . . . 74.040000000000006 111.002 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.841 HD13 HG22 ' A' ' 74' ' ' ILE . 25.4 mt -69.69 -56.79 6.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 65.230000000000004 110.907 179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.47 ' HG3' HG13 ' A' ' 119' ' ' VAL . 11.5 ptp180 -51.0 -34.09 27.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.152 -0.476 . . . . 60.539999999999999 110.911 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.518 HG23 HD23 ' A' ' 126' ' ' LEU . 18.6 m -87.71 -20.31 7.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.155 -0.475 . . . . 73.219999999999999 111.136 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.754 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -75.21 -40.51 59.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.136 -0.484 . . . . 72.209999999999994 110.891 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -49.89 -31.42 12.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 72.409999999999997 110.825 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -94.99 -21.21 18.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 73.219999999999999 110.937 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.754 ' O ' HD13 ' A' ' 120' ' ' LEU . 91.7 m-70 -131.37 91.69 34.3 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.626 0.727 . . . . 61.530000000000001 110.846 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.621 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.8 Cg_endo -69.77 0.7 5.28 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.699 2.266 . . . . 63.340000000000003 112.316 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -114.45 -13.02 12.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.208 -0.451 . . . . 74.540000000000006 110.9 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.518 HD23 HG23 ' A' ' 119' ' ' VAL . 6.3 tp -53.06 -49.28 66.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.143 -0.481 . . . . 71.219999999999999 110.913 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.742 HD12 ' CD1' ' A' ' 91' ' ' ILE . 2.6 pt? -46.65 -32.55 3.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 64.0 110.956 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.39 -38.44 26.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 73.409999999999997 110.929 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.582 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.7 OUTLIER -78.09 -7.59 57.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 71.439999999999998 110.891 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.582 HG23 ' HG3' ' A' ' 129' ' ' GLU . 7.1 pt -118.73 -17.03 7.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.164 -0.471 . . . . 75.140000000000001 111.122 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 65.420000000000002 110.903 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.81 0.338 . . . . 71.030000000000001 110.858 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.495 ' O ' ' HB2' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -174.69 -170.6 0.5 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 75.439999999999998 110.864 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 49.6 t 176.11 59.49 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.613 0.72 . . . . 43.340000000000003 110.867 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 1.04 4.82 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.638 2.225 . . . . 71.420000000000002 112.328 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.469 HG23 ' N ' ' A' ' 6' ' ' CYS . 34.1 m -87.84 -42.63 15.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 73.209999999999994 111.136 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.469 ' N ' HG23 ' A' ' 5' ' ' VAL . 1.2 t -126.97 -24.33 3.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 61.32 110.918 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.432 ' N ' ' O ' ' A' ' 3' ' ' CYS . 16.2 m-70 62.92 47.67 4.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 72.329999999999998 110.785 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -102.25 -75.26 0.6 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 75.219999999999999 110.914 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -110.77 -137.95 7.63 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.694 -0.765 . . . . 52.109999999999999 112.56 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -144.54 104.48 4.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.85 0.357 . . . . 70.420000000000002 110.877 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.558 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -67.43 107.25 2.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 75.519999999999996 110.914 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -146.97 130.89 9.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 64.129999999999995 111.121 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.563 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -47.99 132.24 15.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 73.310000000000002 110.895 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.41 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 177.18 79.69 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.751 -0.738 . . . . 74.040000000000006 112.514 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.41 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.88 146.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.913 0.387 . . . . 74.439999999999998 111.095 -179.941 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.09 -165.72 1.67 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 73.340000000000003 110.913 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.697 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -94.88 116.73 29.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.241 -0.436 . . . . 75.120000000000005 110.91 179.843 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.746 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.0 mm -107.93 90.74 6.81 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.616 0.722 . . . . 71.030000000000001 111.138 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.481 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.73 96.12 0.58 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.706 2.271 . . . . 61.100000000000001 112.332 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.0 t80 -64.58 -35.96 82.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 63.409999999999997 110.84 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.492 HG21 ' HG2' ' A' ' 25' ' ' ARG . 20.2 m -131.35 152.35 50.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.457 . . . . 61.119999999999997 111.16 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -155.29 37.64 0.39 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.257 -0.429 . . . . 73.400000000000006 110.935 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.38 -34.0 1.86 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.157 -0.474 . . . . 71.450000000000003 110.89 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -156.91 -51.0 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.741 -0.742 . . . . 64.209999999999994 112.468 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.492 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -107.71 53.14 0.7 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.859 0.361 . . . . 74.319999999999993 110.883 -179.859 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.408 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 19.4 tttt -56.73 121.11 9.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.487 . . . . 73.319999999999993 110.909 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.414 ' O ' HG23 ' A' ' 27' ' ' THR . 1.8 t -136.8 92.95 2.79 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.288 -0.415 . . . . 73.420000000000002 111.144 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.697 HG11 ' HB2' ' A' ' 17' ' ' ASP . 45.8 t -77.3 128.12 38.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 73.310000000000002 111.151 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.752 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.67 51.88 2.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.188 -0.46 . . . . 62.310000000000002 110.908 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.401 ' C ' ' O ' ' A' ' 29' ' ' LEU . 30.5 mttp -37.25 107.24 0.06 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 71.219999999999999 110.903 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.7 50.03 0.37 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.797 -0.716 . . . . 72.209999999999994 112.526 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.594 HD11 ' HB3' ' A' ' 29' ' ' LEU . 19.1 mm -109.46 92.65 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.894 0.378 . . . . 61.5 111.18 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.42 154.0 37.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 61.350000000000001 110.843 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.64 -108.46 0.31 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.78 -0.724 . . . . 52.539999999999999 112.497 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.755 HD12 ' HB ' ' A' ' 44' ' ' ILE . 61.0 mt -156.67 86.16 0.99 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.85 0.357 . . . . 71.400000000000006 110.986 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.445 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -161.45 164.3 29.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.15 -0.477 . . . . 74.140000000000001 110.923 -179.931 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 9.9 t -169.29 -44.33 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 73.400000000000006 110.835 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.0 m -120.69 -47.41 2.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 53.439999999999998 111.148 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.88 172.71 8.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 71.530000000000001 110.895 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.8 t -138.15 9.86 2.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.425 . . . . 74.129999999999995 110.951 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -97.91 -63.31 1.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 54.200000000000003 110.929 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -76.66 60.59 1.7 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.14 -0.482 . . . . 65.019999999999996 110.933 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.9 p -98.3 158.65 15.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 74.120000000000005 110.854 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.755 ' HB ' HD12 ' A' ' 35' ' ' LEU . 18.3 mm -144.31 139.39 24.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 74.120000000000005 111.169 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.8 mtt -142.06 137.51 31.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.192 -0.458 . . . . 73.230000000000004 110.975 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 40.9 m-20 -89.05 -169.52 2.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 64.129999999999995 110.887 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? -54.78 -59.8 4.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 53.329999999999998 110.857 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -56.84 13.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 74.319999999999993 110.905 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.02 -59.43 4.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.105 -0.498 . . . . 70.329999999999998 110.92 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.9 t -53.62 -41.23 66.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.127 -0.488 . . . . 71.310000000000002 110.89 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -57.6 -45.23 85.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 72.140000000000001 110.876 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.62 -61.04 2.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 63.450000000000003 111.084 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.447 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.5 t80 -52.49 -48.37 65.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 75.510000000000005 110.92 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.431 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.32 -49.32 76.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 72.25 110.842 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.43 -41.71 61.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 62.539999999999999 111.068 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.752 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -70.18 -67.38 0.5 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.449 . . . . 50.130000000000003 110.89 -179.881 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.0 m -46.98 -35.74 3.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 74.129999999999995 111.142 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -69.52 -54.25 15.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 73.219999999999999 110.92 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.25 -51.75 31.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 72.219999999999999 111.124 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.661 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -63.66 -49.13 74.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.167 -0.47 . . . . 72.140000000000001 110.876 -179.874 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.65 -36.68 36.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.043 -0.526 . . . . 72.019999999999996 110.805 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.12 -54.01 9.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.292 -0.413 . . . . 75.129999999999995 111.06 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.29 -28.57 65.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 54.299999999999997 110.837 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.661 HG22 ' O ' ' A' ' 60' ' ' PHE . 19.9 m -94.14 -17.38 7.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.147 -0.479 . . . . 72.400000000000006 111.185 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 74.219999999999999 110.935 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 17.0 m . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.812 0.339 . . . . 73.319999999999993 111.054 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.403 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -105.92 155.45 38.32 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.52 0.676 . . . . 43.119999999999997 111.08 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.471 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.1 Cg_endo -69.68 -6.93 19.74 Favored 'Trans proline' 0 N--CA 1.465 -0.156 0 C-N-CA 122.708 2.272 . . . . 72.519999999999996 112.355 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.06 -34.78 9.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 71.530000000000001 110.905 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.661 ' O ' HG23 ' A' ' 77' ' ' VAL . 16.4 t80 -58.34 -61.83 2.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 71.329999999999998 110.834 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.92 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -39.54 -69.98 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.15 -0.477 . . . . 74.209999999999994 111.105 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.41 HG23 ' N ' ' A' ' 76' ' ' LYS . 35.9 m -49.37 -39.81 13.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 71.120000000000005 111.136 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.41 ' N ' HG23 ' A' ' 75' ' ' VAL . 7.5 mtmt -61.46 -38.29 86.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.152 -0.476 . . . . 74.409999999999997 110.894 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 73' ' ' PHE . 16.6 t -69.81 -38.15 75.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.245 -0.434 . . . . 74.5 111.123 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.2 OUTLIER -69.93 -33.33 72.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.138 -0.483 . . . . 54.240000000000002 110.866 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -88.05 -21.83 24.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.149 -0.478 . . . . 74.109999999999999 110.924 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.488 ' HG2' HD23 ' A' ' 81' ' ' LEU . 18.7 ttmt -74.16 -50.5 19.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.204 -0.453 . . . . 71.230000000000004 110.897 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.799 ' HB2' HD23 ' A' ' 83' ' ' LEU . 12.8 mt -89.71 12.05 18.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.244 -0.434 . . . . 64.349999999999994 111.003 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 65.3 m 53.14 39.8 30.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.149 -0.478 . . . . 54.039999999999999 110.888 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.799 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.7 mm? -79.56 83.99 5.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.125 -0.489 . . . . 70.209999999999994 110.891 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.593 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.43 157.3 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.16 -0.473 . . . . 63.520000000000003 111.164 179.913 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -56.29 -23.19 35.07 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.245 -0.434 . . . . 75.239999999999995 110.921 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.4 mmtp -80.0 -47.1 15.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 73.010000000000005 110.916 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.593 ' H ' HG23 ' A' ' 84' ' ' THR . 8.9 tp10 -67.22 -56.25 10.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.271 -0.422 . . . . 64.099999999999994 110.827 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.432 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -50.79 -38.67 49.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 73.150000000000006 111.045 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 96.6 p -77.53 -32.3 53.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 62.399999999999999 110.86 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -73.72 -28.86 61.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 63.229999999999997 110.925 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.774 HD12 ' HB3' ' A' ' 131' ' ' ARG . 11.4 mm -99.92 -63.59 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 61.130000000000003 111.192 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.647 ' HB3' HG23 ' A' ' 113' ' ' THR . 8.9 m-85 -70.08 -61.57 1.73 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.128 -0.487 . . . . 75.430000000000007 110.863 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 111.95 41.66 1.07 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.755 -0.736 . . . . 44.310000000000002 112.458 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -57.83 -44.95 94.07 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.698 -0.763 . . . . 41.520000000000003 112.495 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.69 -151.2 16.95 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.799 -0.715 . . . . 71.530000000000001 112.505 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.0 t -85.41 -69.1 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.822 0.344 . . . . 62.219999999999999 111.104 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -83.33 39.58 0.67 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 71.140000000000001 110.876 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.21 -79.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.119 -0.491 . . . . 55.140000000000001 111.112 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -37.68 -43.07 0.61 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.343 -0.39 . . . . 75.239999999999995 110.874 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.0 -76.45 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 74.310000000000002 110.833 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.55 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 55.7 mtt180 -50.09 -49.46 51.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 64.230000000000004 110.897 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.486 ' HB3' HD12 ' A' ' 74' ' ' ILE . 8.9 m-85 -51.17 -37.35 45.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.241 -0.436 . . . . 64.349999999999994 110.88 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -51.22 -38.33 51.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 74.530000000000001 110.871 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.95 -18.56 17.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.105 -0.498 . . . . 61.219999999999999 110.902 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.94 26.32 11.71 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.723 -0.751 . . . . 73.049999999999997 112.539 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -96.37 -4.18 42.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.892 0.377 . . . . 71.230000000000004 110.911 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.55 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -120.69 18.4 11.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 22.02 111.093 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.444 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.8 pt20 -126.28 55.91 14.9 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.661 0.743 . . . . 71.140000000000001 110.932 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.494 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.4 Cg_endo -69.74 36.51 0.23 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.698 2.266 . . . . 64.450000000000003 112.327 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.743 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 4.7 t-160 71.67 34.27 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.576 0.703 . . . . 74.340000000000003 110.881 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.743 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.3 Cg_endo -69.79 -164.26 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.648 2.232 . . . . 74.129999999999995 112.33 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 28.3 t -83.64 -30.82 26.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.145 -0.48 . . . . 63.140000000000001 110.876 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.68 HG22 ' CD1' ' A' ' 117' ' ' LEU . 54.1 m -54.94 -50.68 68.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.108 -0.496 . . . . 73.420000000000002 111.102 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.405 ' HA ' HD12 ' A' ' 117' ' ' LEU . 44.0 mm -54.21 -47.75 67.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 62.530000000000001 111.13 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -28.59 70.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.462 . . . . 73.219999999999999 110.968 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.523 ' O ' HD23 ' A' ' 120' ' ' LEU . 5.1 mp -79.59 -42.01 25.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 74.040000000000006 110.932 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.92 HD13 HG22 ' A' ' 74' ' ' ILE . 4.4 mt -61.48 -48.55 80.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 65.230000000000004 110.917 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.527 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.9 ptp180 -54.06 -35.32 61.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 60.539999999999999 110.867 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.584 HG23 HD23 ' A' ' 126' ' ' LEU . 34.5 m -92.97 -10.65 9.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 73.219999999999999 111.159 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.747 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.7 OUTLIER -83.42 -39.98 19.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 72.209999999999994 110.898 179.971 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -50.33 -31.68 15.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 72.409999999999997 110.859 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.16 -19.66 19.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 73.219999999999999 110.938 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.747 ' O ' HD13 ' A' ' 120' ' ' LEU . 88.2 m-70 -130.82 90.39 40.13 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.558 0.694 . . . . 61.530000000000001 110.876 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.558 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.4 Cg_endo -69.73 0.39 5.69 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.664 2.243 . . . . 63.340000000000003 112.289 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -113.93 -11.91 12.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.248 -0.433 . . . . 74.540000000000006 110.874 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.694 ' O ' HG23 ' A' ' 130' ' ' ILE . 6.7 tp -53.95 -47.87 70.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 71.219999999999999 110.892 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.772 HD13 HD11 ' A' ' 83' ' ' LEU . 2.0 pt? -51.0 -28.76 10.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 64.0 110.985 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.481 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.68 -27.21 23.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 73.409999999999997 110.892 179.9 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.403 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.1 pp20? -94.31 2.48 55.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.475 . . . . 71.439999999999998 110.839 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.694 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.5 pt -121.12 -33.99 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 75.140000000000001 111.174 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.774 ' HB3' HD12 ' A' ' 91' ' ' ILE . 2.3 ptt-85 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 65.420000000000002 110.911 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.579 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 4.6 mmt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.877 0.37 . . . . 71.030000000000001 110.916 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.77 -169.35 0.41 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 75.439999999999998 110.902 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 t -179.44 58.6 0.1 Allowed Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.572 0.701 . . . . 43.340000000000003 110.861 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 3.15 2.95 Favored 'Trans proline' 0 N--CA 1.465 -0.2 0 C-N-CA 122.72 2.28 . . . . 71.420000000000002 112.389 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.6 m -107.58 -45.71 7.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.199 -0.455 . . . . 73.209999999999994 111.077 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -106.92 -33.47 7.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 61.32 110.947 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.6 m-70 59.48 24.85 13.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.14 -0.482 . . . . 72.329999999999998 110.827 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -92.14 -67.22 0.87 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 75.219999999999999 110.991 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.74 -135.32 6.36 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.729 -0.748 . . . . 52.109999999999999 112.477 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.579 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 9.5 pt-20 -145.62 95.23 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.841 0.353 . . . . 70.420000000000002 110.913 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.537 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.5 OUTLIER -59.67 104.91 0.32 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.221 -0.445 . . . . 75.519999999999996 110.889 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 8.8 p -145.9 133.04 14.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.43 . . . . 64.129999999999995 111.145 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.537 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -49.25 132.75 19.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.178 -0.464 . . . . 73.310000000000002 110.868 -179.848 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.426 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 178.09 77.58 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.752 -0.737 . . . . 74.040000000000006 112.483 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.426 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -35.65 143.8 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.91 0.386 . . . . 74.439999999999998 111.094 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.31 -168.15 2.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.132 -0.485 . . . . 73.340000000000003 110.912 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -93.27 116.08 28.66 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.22 -0.445 . . . . 75.120000000000005 110.88 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.783 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.6 mm -107.68 91.35 7.24 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.654 0.74 . . . . 71.030000000000001 111.098 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.495 ' HB3' HG12 ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.8 105.1 1.43 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.716 2.277 . . . . 61.100000000000001 112.306 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -70.69 -29.64 66.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.993 0.425 . . . . 63.409999999999997 110.932 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.57 HG21 ' HG2' ' A' ' 25' ' ' ARG . 24.3 m -130.74 146.36 52.19 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.114 -0.493 . . . . 61.119999999999997 111.231 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -140.17 48.23 1.78 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 73.400000000000006 110.908 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.16 -69.03 0.57 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 71.450000000000003 110.847 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -134.56 -40.45 0.17 Allowed Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.746 -0.74 . . . . 64.209999999999994 112.428 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.57 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -102.95 39.61 1.52 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.901 0.381 . . . . 74.319999999999993 110.897 -179.84 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.414 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 11.1 tttt -49.33 109.65 0.29 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 73.319999999999993 110.86 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.597 HG21 ' CD1' ' A' ' 60' ' ' PHE . 2.2 t -128.08 92.27 3.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.275 -0.42 . . . . 73.420000000000002 111.127 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.495 HG12 ' HB3' ' A' ' 19' ' ' PRO . 0.8 OUTLIER -80.33 140.12 17.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 73.310000000000002 111.15 179.865 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.783 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -86.53 63.34 7.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 62.310000000000002 110.955 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.9 mttp -41.46 105.56 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 71.219999999999999 110.858 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.531 ' O ' HD13 ' A' ' 32' ' ' ILE . . . 115.5 62.1 0.37 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.653 -0.784 . . . . 72.209999999999994 112.398 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.598 HD11 ' CB ' ' A' ' 29' ' ' LEU . 19.4 mm -118.31 92.3 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.852 0.358 . . . . 61.5 111.151 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.12 153.25 39.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 61.350000000000001 110.827 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 168.22 -109.63 0.35 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.751 -0.738 . . . . 52.539999999999999 112.497 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.755 HD12 ' HB ' ' A' ' 44' ' ' ILE . 61.4 mt -156.82 85.81 0.97 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.89 0.376 . . . . 71.400000000000006 110.892 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.418 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -158.75 163.35 36.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.161 -0.472 . . . . 74.140000000000001 110.895 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -168.38 -47.27 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.068 -0.515 . . . . 73.400000000000006 110.93 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.404 HG22 ' HG2' ' A' ' 10' ' ' GLU . 4.2 m -120.54 -47.05 2.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 53.439999999999998 111.186 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -87.45 169.42 12.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.167 -0.469 . . . . 71.530000000000001 110.849 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.4 m -136.84 15.15 3.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 74.129999999999995 110.892 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -103.79 -62.88 1.25 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.157 -0.474 . . . . 54.200000000000003 110.925 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.447 ' HG3' ' HE3' ' A' ' 11' ' ' MET . 7.7 tp10 -77.14 61.91 2.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 65.019999999999996 110.891 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.3 p -98.03 155.64 17.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.491 . . . . 74.120000000000005 110.923 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.755 ' HB ' HD12 ' A' ' 35' ' ' LEU . 21.0 mm -141.84 140.45 30.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.466 . . . . 74.120000000000005 111.135 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.8 mtt -144.53 134.79 24.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 73.230000000000004 110.884 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.3 m-20 -81.93 -169.85 2.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 64.129999999999995 110.851 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.06 -60.1 4.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 53.329999999999998 110.934 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -51.76 -57.44 9.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.275 -0.42 . . . . 74.319999999999993 110.899 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.42 -58.75 5.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 70.329999999999998 110.912 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.9 t -53.74 -38.88 64.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 71.310000000000002 110.821 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.75 -43.99 97.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.096 -0.502 . . . . 72.140000000000001 110.904 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.83 -58.34 6.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 63.450000000000003 111.069 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -54.42 -47.3 72.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.257 -0.429 . . . . 75.510000000000005 110.869 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.82 -50.44 68.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.131 -0.486 . . . . 72.25 110.857 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.5 -41.2 60.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 62.539999999999999 111.107 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.741 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.7 OUTLIER -69.97 -66.99 0.52 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 50.130000000000003 110.946 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.43 HG12 HD21 ' A' ' 29' ' ' LEU . 18.1 m -47.82 -35.51 4.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 74.129999999999995 111.092 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -69.05 -54.43 15.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 73.219999999999999 110.87 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.62 -52.44 39.48 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 72.219999999999999 111.134 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.622 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -64.48 -44.69 90.23 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.449 . . . . 72.140000000000001 110.893 -179.975 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.0 mtt-85 -50.7 -51.63 47.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.158 -0.473 . . . . 72.019999999999996 110.933 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.69 -54.14 36.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 75.129999999999995 111.044 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.62 -38.58 32.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 54.299999999999997 110.878 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.622 HG23 ' O ' ' A' ' 60' ' ' PHE . 44.4 t -82.4 -25.99 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 72.400000000000006 111.121 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.159 -0.473 . . . . 74.219999999999999 110.867 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 17.6 m . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.828 0.347 . . . . 73.319999999999993 111.136 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -103.14 153.73 38.15 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.541 0.686 . . . . 43.119999999999997 111.021 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.528 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.2 Cg_endo -69.67 -7.69 21.68 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.685 2.257 . . . . 72.519999999999996 112.367 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -98.85 -36.31 9.83 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.201 -0.454 . . . . 71.530000000000001 110.852 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.564 ' O ' HG23 ' A' ' 77' ' ' VAL . 19.8 t80 -57.76 -61.13 2.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.194 -0.457 . . . . 71.329999999999998 110.896 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.77 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -40.01 -70.47 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 74.209999999999994 111.17 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.7 m -48.85 -38.87 10.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.151 -0.477 . . . . 71.120000000000005 111.205 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.6 mtmt -62.77 -39.05 92.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 74.409999999999997 110.802 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 73' ' ' PHE . 39.3 t -68.07 -38.07 79.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.268 -0.424 . . . . 74.5 111.121 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.423 ' HG3' ' O ' ' A' ' 74' ' ' ILE . 0.7 OUTLIER -70.33 -36.51 74.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 54.240000000000002 110.851 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -84.08 -20.84 31.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.169 -0.469 . . . . 74.109999999999999 110.895 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.462 ' HG2' HD23 ' A' ' 81' ' ' LEU . 5.5 ttmt -75.59 -50.19 16.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 71.230000000000004 110.87 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.816 ' HB2' HD23 ' A' ' 83' ' ' LEU . 12.9 mt -90.19 12.22 18.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 64.349999999999994 110.918 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.3 t 52.47 40.8 30.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 54.039999999999999 110.851 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.816 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.6 mm? -79.13 84.61 5.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 70.209999999999994 110.864 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.595 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.29 156.33 0.11 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 63.520000000000003 111.131 179.943 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -58.33 -24.7 60.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 75.239999999999995 110.9 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -77.08 -49.01 16.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 73.010000000000005 110.945 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.595 ' H ' HG23 ' A' ' 84' ' ' THR . 0.8 OUTLIER -68.98 -54.83 13.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.226 -0.443 . . . . 64.099999999999994 110.919 179.903 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.572 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -51.69 -35.35 42.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 73.150000000000006 111.104 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.2 m -78.67 -37.07 42.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 62.399999999999999 110.892 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -72.76 -24.79 61.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.128 -0.487 . . . . 63.229999999999997 110.82 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.717 ' CD1' HD12 ' A' ' 127' ' ' LEU . 51.9 mt -101.47 -64.09 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 61.130000000000003 111.112 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.54 ' HB3' HG23 ' A' ' 113' ' ' THR . 8.0 m-85 -71.72 -61.26 1.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 75.430000000000007 110.975 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.65 45.01 1.0 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.796 -0.716 . . . . 44.310000000000002 112.458 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -66.59 -46.62 74.9 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.751 -0.738 . . . . 41.520000000000003 112.564 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.49 172.54 21.45 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.717 -0.754 . . . . 71.530000000000001 112.5 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.675 HG13 ' H ' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -50.9 -66.64 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.869 0.366 . . . . 62.219999999999999 111.099 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.675 ' H ' HG13 ' A' ' 96' ' ' VAL . 9.0 t30 -86.24 42.23 0.98 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.155 -0.475 . . . . 71.140000000000001 110.882 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.13 -76.18 0.06 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 55.140000000000001 111.145 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -39.66 -40.32 0.89 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 75.239999999999995 110.866 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.9 m -59.93 -76.28 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.163 -0.471 . . . . 74.310000000000002 110.89 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.604 ' HB3' ' HB2' ' A' ' 107' ' ' ALA . 24.6 mtt85 -49.93 -45.66 51.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.102 -0.499 . . . . 64.230000000000004 110.885 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.491 ' HB3' HD12 ' A' ' 74' ' ' ILE . 10.4 m-85 -56.96 -36.57 70.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 64.349999999999994 110.943 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 -59.81 -25.98 65.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.104 -0.498 . . . . 74.530000000000001 110.891 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.11 -20.5 14.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 61.219999999999999 110.903 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.15 28.38 11.9 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.742 -0.742 . . . . 73.049999999999997 112.564 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -104.35 -8.65 19.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.819 0.342 . . . . 71.230000000000004 110.926 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.604 ' HB2' ' HB3' ' A' ' 101' ' ' ARG . . . -114.52 15.14 17.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 22.02 111.12 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.443 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 1.9 pt20 -127.04 54.6 12.63 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.529 0.68 . . . . 71.140000000000001 110.904 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.502 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.0 Cg_endo -69.75 37.03 0.24 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.642 2.228 . . . . 64.450000000000003 112.347 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.748 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.5 t-160 71.9 34.06 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.65 0.738 . . . . 74.340000000000003 110.856 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.748 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.4 Cg_endo -69.77 -164.07 0.12 Allowed 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.665 2.243 . . . . 74.129999999999995 112.412 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.94 -32.77 30.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.311 -0.404 . . . . 63.140000000000001 110.874 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.54 HG23 ' HB3' ' A' ' 92' ' ' PHE . 21.0 m -52.3 -55.35 21.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.476 . . . . 73.420000000000002 111.176 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 42.7 mm -50.94 -46.55 30.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 62.530000000000001 111.116 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.442 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -62.52 -28.53 69.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 73.219999999999999 110.894 179.853 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.442 HD12 ' HG3' ' A' ' 115' ' ' LYS . 5.8 mp -81.29 -47.5 13.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.265 -0.425 . . . . 74.040000000000006 110.922 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.77 HD13 HG22 ' A' ' 74' ' ' ILE . 21.5 mt -55.91 -47.75 76.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.47 . . . . 65.230000000000004 110.995 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.614 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.0 ptp180 -54.91 -35.6 64.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 60.539999999999999 110.915 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.614 HG13 ' HG3' ' A' ' 118' ' ' ARG . 31.7 m -95.7 -3.46 10.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 73.219999999999999 111.145 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.747 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -89.68 -40.73 12.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 72.209999999999994 110.909 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -49.31 -32.43 11.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.256 -0.429 . . . . 72.409999999999997 110.849 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.47 -20.53 18.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 73.219999999999999 110.856 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.747 ' O ' HD13 ' A' ' 120' ' ' LEU . 48.0 m-70 -127.36 87.34 56.53 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.602 0.715 . . . . 61.530000000000001 110.865 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.602 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.6 Cg_endo -69.73 3.9 2.49 Favored 'Trans proline' 0 C--N 1.341 0.14 0 C-N-CA 122.747 2.298 . . . . 63.340000000000003 112.338 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -117.91 -12.42 10.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 74.540000000000006 110.897 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.557 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.7 tp -53.6 -48.09 69.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 71.219999999999999 110.958 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.717 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.8 pt? -46.33 -32.75 3.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 64.0 110.922 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -81.96 -38.08 25.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 73.409999999999997 110.927 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.551 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -78.72 -5.72 53.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.479 . . . . 71.439999999999998 110.892 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.557 HG23 ' O ' ' A' ' 126' ' ' LEU . 8.7 pt -118.14 -22.26 4.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.152 -0.476 . . . . 75.140000000000001 111.133 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.193 -0.458 . . . . 65.420000000000002 110.889 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mtt . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.838 0.352 . . . . 71.030000000000001 110.879 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.24 -171.21 0.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.192 -0.458 . . . . 75.439999999999998 110.906 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.403 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 0.5 OUTLIER 175.79 56.72 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.651 0.739 . . . . 43.340000000000003 110.96 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 53.3 Cg_endo -69.73 2.39 3.56 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.724 2.282 . . . . 71.420000000000002 112.327 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.596 HG23 ' HG3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -99.89 -44.6 11.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.448 . . . . 73.209999999999994 111.144 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 7' ' ' HIS . 0.1 OUTLIER -112.2 -40.01 4.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.169 -0.469 . . . . 61.32 110.894 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 24.6 m-70 69.29 51.63 0.5 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 72.329999999999998 110.854 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.31 -71.95 0.71 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 75.219999999999999 110.949 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -99.61 -121.38 4.6 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.669 -0.776 . . . . 52.109999999999999 112.556 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.504 ' O ' HG12 ' A' ' 12' ' ' VAL . 12.8 pt-20 -169.29 87.52 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.804 0.335 . . . . 70.420000000000002 110.938 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.522 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -46.04 105.71 0.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 75.519999999999996 110.869 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.504 HG12 ' O ' ' A' ' 10' ' ' GLU . 4.9 p -144.57 129.2 13.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 64.129999999999995 111.148 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.494 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.6 p -47.5 126.23 9.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 73.310000000000002 110.89 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.88 80.99 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.692 -0.766 . . . . 74.040000000000006 112.429 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.409 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.27 147.24 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.88 0.371 . . . . 74.439999999999998 111.097 -179.955 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.32 -165.32 1.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 73.340000000000003 110.899 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.656 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -96.54 117.34 30.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.262 -0.426 . . . . 75.120000000000005 110.851 179.914 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.724 ' O ' HD22 ' A' ' 29' ' ' LEU . 10.7 mm -108.05 91.3 7.68 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.639 0.733 . . . . 71.030000000000001 111.146 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.402 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.1 Cg_endo -69.7 96.26 0.58 Allowed 'Trans proline' 0 N--CA 1.464 -0.217 0 C-N-CA 122.754 2.302 . . . . 61.100000000000001 112.38 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.499 ' HB3' HG23 ' A' ' 27' ' ' THR . 14.2 t80 -64.29 -34.61 78.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 63.409999999999997 110.926 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.586 HG21 ' HG2' ' A' ' 25' ' ' ARG . 17.5 m -130.29 146.89 51.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 61.119999999999997 111.155 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -144.63 43.49 1.37 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 73.400000000000006 110.917 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.408 ' CD ' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -131.28 -39.64 1.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 71.450000000000003 110.802 -179.869 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -160.48 -53.23 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.736 -0.745 . . . . 64.209999999999994 112.495 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.586 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.75 42.44 1.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.867 0.365 . . . . 74.319999999999993 110.925 -179.897 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.402 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 15.1 tttm -49.77 117.47 2.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 73.319999999999993 110.893 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.499 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -128.91 91.04 3.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 73.420000000000002 111.08 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.656 HG11 ' HB2' ' A' ' 17' ' ' ASP . 43.0 t -76.62 126.7 37.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.232 -0.44 . . . . 73.310000000000002 111.132 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.73 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.77 51.78 2.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 62.310000000000002 110.913 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -38.59 107.47 0.07 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 71.219999999999999 110.922 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.24 46.09 0.38 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.755 -0.736 . . . . 72.209999999999994 112.5 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.566 HD11 ' HB3' ' A' ' 29' ' ' LEU . 13.4 mm -107.37 89.98 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.923 0.392 . . . . 61.5 111.146 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.33 156.43 38.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 61.350000000000001 110.875 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.13 -107.39 0.28 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.721 -0.752 . . . . 52.539999999999999 112.456 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.732 HD12 ' HB ' ' A' ' 44' ' ' ILE . 55.6 mt -156.27 82.47 0.99 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.896 0.379 . . . . 71.400000000000006 110.87 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.469 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -164.88 166.23 19.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.46 . . . . 74.140000000000001 110.91 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.5 -34.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 73.400000000000006 110.85 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.3 m -121.34 -45.28 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 53.439999999999998 111.087 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -98.94 176.02 5.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 71.530000000000001 110.856 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.5 p -141.25 28.81 1.84 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.205 -0.452 . . . . 74.129999999999995 110.85 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -110.49 -65.68 1.14 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.173 -0.467 . . . . 54.200000000000003 110.922 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.596 ' HG3' HG23 ' A' ' 5' ' ' VAL . 27.4 mm-40 -76.56 62.29 1.9 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 65.019999999999996 110.937 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.1 p -93.05 138.62 31.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 74.120000000000005 110.874 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.732 ' HB ' HD12 ' A' ' 35' ' ' LEU . 13.3 mm -135.71 138.91 47.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.086 -0.507 . . . . 74.120000000000005 111.115 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 15.2 mtt -139.3 143.19 37.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 73.230000000000004 110.854 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.6 m-20 -90.82 -168.91 2.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 64.129999999999995 110.844 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.17 -60.41 3.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.131 -0.486 . . . . 53.329999999999998 110.996 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.92 -58.24 7.61 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.139 -0.482 . . . . 74.319999999999993 110.9 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -50.5 -59.35 4.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 70.329999999999998 110.915 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.0 t -52.45 -42.91 64.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 71.310000000000002 110.78 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -57.38 -43.38 83.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.152 -0.476 . . . . 72.140000000000001 110.842 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.45 -61.93 1.82 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 63.450000000000003 111.113 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.477 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.7 t80 -52.56 -45.84 66.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.179 -0.464 . . . . 75.510000000000005 110.887 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.434 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -64.2 -50.41 68.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 72.25 110.842 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.21 -41.73 60.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.303 -0.408 . . . . 62.539999999999999 111.153 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.73 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -70.64 -66.99 0.53 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 50.130000000000003 110.93 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.477 HG13 ' O ' ' A' ' 53' ' ' PHE . 16.3 m -47.03 -35.64 3.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.257 -0.429 . . . . 74.129999999999995 111.094 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 11.0 mmmm -70.31 -51.91 26.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 73.219999999999999 110.939 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.4 -52.32 46.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.47 . . . . 72.219999999999999 111.14 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.644 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -65.29 -46.24 81.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 72.140000000000001 110.883 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -49.88 -52.49 32.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.104 -0.498 . . . . 72.019999999999996 110.866 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.82 -54.54 33.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 75.129999999999995 111.094 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.69 -42.05 33.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 54.299999999999997 110.836 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 60' ' ' PHE . 42.9 t -77.15 -28.49 16.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.164 -0.471 . . . . 72.400000000000006 111.142 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 74.219999999999999 110.853 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 17.0 m . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.912 0.387 . . . . 73.319999999999993 111.049 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.5 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -104.92 158.17 32.61 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.547 0.689 . . . . 43.119999999999997 111.075 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.5 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.8 Cg_endo -69.79 -8.15 22.88 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.604 2.202 . . . . 72.519999999999996 112.42 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -97.81 -34.87 10.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 71.530000000000001 110.797 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -57.5 -61.12 2.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.454 . . . . 71.329999999999998 110.9 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.867 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.82 -68.04 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 74.209999999999994 111.104 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -48.66 -38.88 10.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 71.120000000000005 111.177 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.8 mtmt -61.14 -45.5 94.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.456 . . . . 74.409999999999997 110.935 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.534 HG22 ' HB2' ' A' ' 121' ' ' ASP . 78.5 t -62.03 -39.48 83.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 74.5 111.112 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.465 HH22 HG21 ' A' ' 113' ' ' THR . 0.2 OUTLIER -63.64 -58.65 6.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 54.240000000000002 110.854 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -24.1 67.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 74.109999999999999 110.979 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.2 ttmt -67.97 -53.67 24.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 71.230000000000004 110.879 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.807 ' HB2' HD23 ' A' ' 83' ' ' LEU . 10.9 mt -90.68 12.79 17.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.192 -0.458 . . . . 64.349999999999994 110.947 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.3 t 53.5 38.41 28.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.117 -0.492 . . . . 54.039999999999999 110.915 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.807 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.8 mm? -79.58 87.04 5.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.127 -0.488 . . . . 70.209999999999994 110.943 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.637 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.55 157.4 0.1 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 63.520000000000003 111.115 179.976 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -57.55 -21.49 38.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 75.239999999999995 110.921 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -81.16 -49.21 11.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 73.010000000000005 110.957 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.637 ' H ' HG23 ' A' ' 84' ' ' THR . 21.9 tp10 -62.47 -54.31 42.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.448 . . . . 64.099999999999994 110.863 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.41 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -54.72 -35.8 64.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.483 . . . . 73.150000000000006 111.083 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 91.5 p -79.68 -26.11 41.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 62.399999999999999 110.832 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.93 -25.88 34.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.469 . . . . 63.229999999999997 110.873 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.734 HD12 ' HB3' ' A' ' 131' ' ' ARG . 24.5 mm -103.35 -59.05 3.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.157 -0.474 . . . . 61.130000000000003 111.17 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.581 ' HB3' HG23 ' A' ' 113' ' ' THR . 5.8 m-85 -75.77 -60.96 2.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 75.430000000000007 110.87 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.3 49.44 0.76 Allowed Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.711 -0.756 . . . . 44.310000000000002 112.527 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.79 -37.39 34.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 41.520000000000003 112.509 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLY . . . . . 0.418 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 102.11 165.71 26.8 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.685 -0.769 . . . . 71.530000000000001 112.467 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.493 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.9 p -51.4 -50.67 27.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.832 0.348 . . . . 62.219999999999999 111.15 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.493 ' N ' HG13 ' A' ' 96' ' ' VAL . 14.2 p30 -86.93 37.73 0.77 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 71.140000000000001 110.928 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.418 ' HB2' ' O ' ' A' ' 95' ' ' GLY . . . -64.46 -76.43 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 55.140000000000001 111.11 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -43.25 -39.97 3.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 75.239999999999995 110.893 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.37 -75.38 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 74.310000000000002 110.876 -179.777 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.619 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 44.6 mtt180 -49.92 -45.02 50.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.075 -0.512 . . . . 64.230000000000004 110.892 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.723 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.0 m-85 -56.35 -37.54 70.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 64.349999999999994 110.909 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -53.35 -27.43 23.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.075 -0.511 . . . . 74.530000000000001 110.892 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.56 -22.2 12.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 61.219999999999999 110.9 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.23 28.16 9.43 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.77 -0.729 . . . . 73.049999999999997 112.48 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -100.36 -6.87 25.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.362 . . . . 71.230000000000004 110.915 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.619 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -109.74 10.68 24.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.189 -0.46 . . . . 22.02 111.101 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.45 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.9 pt20 -125.61 56.96 16.11 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.585 0.707 . . . . 71.140000000000001 110.96 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.532 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.8 Cg_endo -69.75 36.38 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.698 2.265 . . . . 64.450000000000003 112.317 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.773 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.6 t60 73.89 32.33 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.646 0.736 . . . . 74.340000000000003 110.865 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.773 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 52.9 Cg_endo -69.8 -163.98 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.721 2.281 . . . . 74.129999999999995 112.301 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.0 p -86.94 -28.95 22.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.235 -0.439 . . . . 63.140000000000001 110.87 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.583 HG22 HD12 ' A' ' 117' ' ' LEU . 22.0 m -53.5 -51.38 62.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.162 -0.472 . . . . 73.420000000000002 111.17 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.418 HD11 ' HB2' ' A' ' 108' ' ' GLN . 38.9 mm -51.26 -42.52 26.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 62.530000000000001 111.105 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.537 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -67.44 -29.92 69.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.154 -0.475 . . . . 73.219999999999999 110.915 179.815 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.537 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.7 mp -79.23 -41.72 27.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.456 . . . . 74.040000000000006 110.922 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.867 HD13 HG22 ' A' ' 74' ' ' ILE . 13.8 mt -63.66 -49.51 72.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 65.230000000000004 110.902 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.58 ' HG3' HG13 ' A' ' 119' ' ' VAL . 14.5 ptp180 -52.07 -35.7 48.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 60.539999999999999 110.882 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.58 HG13 ' HG3' ' A' ' 118' ' ' ARG . 31.0 m -92.57 -14.07 8.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 73.219999999999999 111.099 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.768 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -77.04 -39.64 49.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.268 -0.424 . . . . 72.209999999999994 110.874 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ASP . . . . . 0.534 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.8 OUTLIER -50.44 -31.44 15.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.174 -0.466 . . . . 72.409999999999997 110.871 179.873 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -95.8 -19.86 19.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 73.219999999999999 110.966 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.768 ' O ' HD13 ' A' ' 120' ' ' LEU . 81.7 m-70 -131.41 90.07 38.92 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.589 0.709 . . . . 61.530000000000001 110.801 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.723 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.0 Cg_endo -69.71 0.13 6.05 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.745 2.297 . . . . 63.340000000000003 112.324 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -113.8 -11.95 12.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 74.540000000000006 110.882 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.68 ' O ' HG23 ' A' ' 130' ' ' ILE . 6.3 tp -53.6 -47.84 69.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.118 -0.492 . . . . 71.219999999999999 110.96 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.748 HD13 HD11 ' A' ' 83' ' ' LEU . 2.2 pt? -51.1 -29.0 11.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.12 -0.491 . . . . 64.0 110.968 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.487 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.67 -26.07 24.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.174 -0.466 . . . . 73.409999999999997 110.906 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.413 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.0 OUTLIER -95.88 3.31 53.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 71.439999999999998 110.917 179.943 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.68 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.8 pt -122.25 -34.52 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 75.140000000000001 111.093 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.734 ' HB3' HD12 ' A' ' 91' ' ' ILE . 1.3 ptt-85 . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 65.420000000000002 110.84 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mtt . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.884 0.374 . . . . 71.030000000000001 110.835 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.63 -169.53 0.43 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.429 . . . . 75.439999999999998 110.891 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.5 p 176.88 57.17 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.623 0.725 . . . . 43.340000000000003 110.875 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.79 0.52 5.55 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.715 2.277 . . . . 71.420000000000002 112.302 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 2.9 m -91.99 -40.37 12.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 73.209999999999994 111.2 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 7' ' ' HIS . 0.0 OUTLIER -122.9 -36.33 2.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 61.32 110.858 179.981 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 24.0 m-70 70.49 61.84 0.21 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 72.329999999999998 110.844 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.8 -77.15 0.57 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 75.219999999999999 110.96 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.402 ' HA3' ' HB3' ' A' ' 39' ' ' HIS . . . -94.43 -118.02 2.98 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.785 -0.722 . . . . 52.109999999999999 112.478 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.585 ' O ' HG12 ' A' ' 12' ' ' VAL . 8.2 pt-20 -177.45 96.57 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.905 0.383 . . . . 70.420000000000002 110.935 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.462 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -48.36 103.74 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 75.519999999999996 110.89 -179.974 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.585 HG12 ' O ' ' A' ' 10' ' ' GLU . 3.1 p -141.71 125.11 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 64.129999999999995 111.117 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.508 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.2 p -46.66 128.55 10.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.256 -0.429 . . . . 73.310000000000002 110.909 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.423 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . -179.7 79.94 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.722 -0.751 . . . . 74.040000000000006 112.47 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.423 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.42 146.16 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.905 0.383 . . . . 74.439999999999998 111.151 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.8 -166.3 1.96 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 73.340000000000003 110.906 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.636 ' HB2' HG11 ' A' ' 28' ' ' VAL . 1.4 p30 -94.63 119.73 33.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 75.120000000000005 110.825 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.712 ' O ' HD22 ' A' ' 29' ' ' LEU . 10.3 mm -110.78 92.15 13.97 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.596 0.713 . . . . 71.030000000000001 111.181 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.416 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.67 94.87 0.53 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.696 2.264 . . . . 61.100000000000001 112.369 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -60.75 -39.02 87.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 63.409999999999997 110.961 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.416 HG21 ' HG2' ' A' ' 25' ' ' ARG . 11.3 m -130.67 145.12 51.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.072 -0.513 . . . . 61.119999999999997 111.153 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 16.4 p90 -136.12 47.49 2.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.231 -0.44 . . . . 73.400000000000006 110.938 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.51 -68.58 0.57 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 71.450000000000003 110.89 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.07 -44.88 0.1 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.746 -0.74 . . . . 64.209999999999994 112.494 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.416 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -97.79 40.37 1.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.907 0.384 . . . . 74.319999999999993 110.92 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -53.92 124.22 14.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 73.319999999999993 110.9 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.403 ' O ' HG23 ' A' ' 27' ' ' THR . 1.7 t -139.2 94.46 2.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.142 -0.481 . . . . 73.420000000000002 111.131 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.636 HG11 ' HB2' ' A' ' 17' ' ' ASP . 45.1 t -76.8 127.4 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 73.310000000000002 111.151 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.764 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.86 51.57 2.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.172 -0.467 . . . . 62.310000000000002 110.916 179.956 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 29' ' ' LEU . 22.0 mttp -38.46 107.22 0.06 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 71.219999999999999 110.888 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.52 45.51 0.39 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.767 -0.73 . . . . 72.209999999999994 112.487 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.558 HD11 ' HB3' ' A' ' 29' ' ' LEU . 15.2 mm -106.3 91.38 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.854 0.359 . . . . 61.5 111.097 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.0 156.87 37.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 61.350000000000001 110.827 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.22 -106.89 0.28 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.79 -0.719 . . . . 52.539999999999999 112.518 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.753 HD12 ' HB ' ' A' ' 44' ' ' ILE . 50.3 mt -156.17 83.35 1.0 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.88 0.372 . . . . 71.400000000000006 110.845 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.534 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -167.97 161.69 12.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.489 . . . . 74.140000000000001 110.909 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.35 -33.61 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.161 -0.472 . . . . 73.400000000000006 110.886 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.402 HG11 ' HG2' ' A' ' 10' ' ' GLU . 4.5 p -118.93 -24.7 3.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 53.439999999999998 111.128 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.402 ' HB3' ' HA3' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -126.17 177.96 6.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.166 -0.47 . . . . 71.530000000000001 110.809 179.978 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.8 p -138.92 9.95 2.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 74.129999999999995 110.885 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -92.98 -66.04 0.95 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 54.200000000000003 110.901 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -75.71 60.92 1.33 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.49 . . . . 65.019999999999996 110.87 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.9 p -94.19 149.54 21.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.15 -0.477 . . . . 74.120000000000005 110.88 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.753 ' HB ' HD12 ' A' ' 35' ' ' LEU . 16.5 mm -144.1 137.95 24.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.481 . . . . 74.120000000000005 111.156 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.7 mtt -139.65 143.58 37.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.246 -0.434 . . . . 73.230000000000004 110.863 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -97.14 -168.55 1.72 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 64.129999999999995 110.853 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.48 -56.32 19.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.116 -0.493 . . . . 53.329999999999998 110.926 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -57.0 -58.3 8.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 74.319999999999993 110.928 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.68 -60.29 3.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.133 -0.485 . . . . 70.329999999999998 110.891 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.2 t -53.37 -39.41 64.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 71.310000000000002 110.856 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.69 -45.83 88.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.088 -0.505 . . . . 72.140000000000001 110.863 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.86 -59.16 4.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 63.450000000000003 111.089 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.455 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.1 t80 -53.3 -48.23 68.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.17 -0.468 . . . . 75.510000000000005 110.858 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.421 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.24 -48.72 77.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 72.25 110.914 179.959 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.5 -40.49 62.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 62.539999999999999 111.072 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.764 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.9 OUTLIER -71.09 -66.63 0.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.147 -0.478 . . . . 50.130000000000003 110.884 -179.885 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.2 m -47.6 -35.16 4.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.171 -0.468 . . . . 74.129999999999995 111.096 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -71.19 -52.04 21.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 73.219999999999999 110.918 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.47 -49.0 62.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.449 . . . . 72.219999999999999 111.129 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.618 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -67.0 -48.09 69.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 72.140000000000001 110.946 -179.965 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -49.67 -48.96 49.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 72.019999999999996 110.881 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.36 -55.88 13.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.491 . . . . 75.129999999999995 111.125 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.54 -40.88 39.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.21 -0.45 . . . . 54.299999999999997 110.84 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 60' ' ' PHE . 36.4 t -80.27 -25.28 11.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 72.400000000000006 111.15 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 74.219999999999999 110.901 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.557 HG11 HG23 ' A' ' 74' ' ' ILE . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.87 0.367 . . . . 73.319999999999993 111.081 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.609 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -81.76 161.14 62.18 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.552 0.691 . . . . 43.119999999999997 111.071 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.609 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.5 Cg_endo -69.76 -6.98 19.89 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.706 2.271 . . . . 72.519999999999996 112.311 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -99.82 -37.8 8.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 71.530000000000001 110.89 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -57.04 -62.17 1.94 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.143 -0.48 . . . . 71.329999999999998 110.879 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.7 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -43.73 -68.09 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 74.209999999999994 111.102 179.963 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.5 m -49.08 -39.1 11.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.111 -0.495 . . . . 71.120000000000005 111.092 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -61.42 -37.77 84.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 74.409999999999997 110.825 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.487 HG22 ' HB2' ' A' ' 121' ' ' ASP . 97.2 t -70.67 -38.39 72.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.274 -0.421 . . . . 74.5 111.127 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.9 OUTLIER -69.83 -33.22 72.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 54.240000000000002 110.899 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -89.75 -19.17 25.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 74.109999999999999 110.886 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.2 ttmm -75.85 -51.62 12.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.265 -0.425 . . . . 71.230000000000004 110.861 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.838 HD13 HD12 ' A' ' 120' ' ' LEU . 7.3 mt -91.49 14.47 14.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.245 -0.434 . . . . 64.349999999999994 110.922 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.02 43.19 29.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.439 . . . . 54.039999999999999 110.915 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.805 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.3 mm? -79.18 86.07 5.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.099 -0.5 . . . . 70.209999999999994 110.925 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.593 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -46.85 155.8 0.24 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 63.520000000000003 111.14 179.92 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.61 -22.24 61.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 75.239999999999995 110.991 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -77.34 -54.25 6.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 73.010000000000005 110.949 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.593 ' H ' HG23 ' A' ' 84' ' ' THR . 0.1 OUTLIER -65.5 -51.75 57.77 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.181 -0.463 . . . . 64.099999999999994 110.969 179.899 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.428 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -53.91 -32.68 54.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 73.150000000000006 111.021 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 13.7 t -80.34 -35.8 35.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 62.399999999999999 110.842 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -75.77 -21.13 57.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.088 -0.506 . . . . 63.229999999999997 110.896 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.728 ' CD1' HD12 ' A' ' 127' ' ' LEU . 55.7 mt -104.93 -62.35 2.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 61.130000000000003 111.112 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.54 ' HB3' HG23 ' A' ' 113' ' ' THR . 7.4 m-85 -75.31 -61.58 1.85 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 75.430000000000007 110.921 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 113.17 48.16 0.62 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.723 -0.751 . . . . 44.310000000000002 112.422 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.455 ' C ' ' HB2' ' A' ' 98' ' ' ALA . . . -69.78 -41.06 74.95 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.732 -0.747 . . . . 41.520000000000003 112.436 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 100.87 -155.85 19.27 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.76 -0.733 . . . . 71.530000000000001 112.533 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.5 t -80.56 -70.25 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 62.219999999999999 111.161 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -84.9 41.24 0.85 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.112 -0.494 . . . . 71.140000000000001 110.913 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.455 ' HB2' ' C ' ' A' ' 94' ' ' GLY . . . -61.61 -73.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 55.140000000000001 111.041 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -40.36 -41.68 1.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 75.239999999999995 110.871 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -60.1 -75.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 74.310000000000002 110.893 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.603 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 10.5 mtt180 -48.5 -47.9 38.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 64.230000000000004 110.886 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.572 ' HB3' HD12 ' A' ' 74' ' ' ILE . 10.5 m-85 -55.02 -37.78 67.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 64.349999999999994 110.943 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -53.3 -31.84 45.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 74.530000000000001 110.919 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.84 -20.5 14.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.116 -0.493 . . . . 61.219999999999999 110.909 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.63 25.41 13.58 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.731 -0.747 . . . . 73.049999999999997 112.541 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 28.4 m120 -98.38 -5.31 32.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.884 0.373 . . . . 71.230000000000004 110.909 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.603 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -118.02 17.17 14.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 22.02 111.093 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.448 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 1.9 pt20 -126.32 54.01 10.37 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.572 0.701 . . . . 71.140000000000001 110.948 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.506 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.2 Cg_endo -69.66 39.79 0.28 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.705 2.27 . . . . 64.450000000000003 112.34 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.736 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.3 m170 71.0 35.51 0.09 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.546 0.689 . . . . 74.340000000000003 110.898 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.736 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.2 Cg_endo -69.75 -164.05 0.12 Allowed 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.641 2.228 . . . . 74.129999999999995 112.353 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.501 ' O ' HD13 ' A' ' 116' ' ' LEU . 1.5 m -89.17 -23.84 22.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 63.140000000000001 110.831 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.54 HG23 ' HB3' ' A' ' 92' ' ' PHE . 21.1 m -61.49 -45.95 92.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.114 -0.494 . . . . 73.420000000000002 111.139 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 44.0 mm -56.35 -43.38 77.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 62.530000000000001 111.064 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.517 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -69.24 -33.75 73.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.142 -0.481 . . . . 73.219999999999999 110.873 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.712 ' HG ' HD12 ' A' ' 130' ' ' ILE . 7.5 mp -74.39 -38.12 63.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.235 -0.438 . . . . 74.040000000000006 110.918 179.874 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.7 HD13 HG22 ' A' ' 74' ' ' ILE . 33.7 mt -68.46 -51.42 43.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 65.230000000000004 110.974 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.559 ' HG3' HG13 ' A' ' 119' ' ' VAL . 14.7 ptp180 -50.33 -34.46 23.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 60.539999999999999 110.864 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.785 HG23 HD13 ' A' ' 126' ' ' LEU . 21.7 m -91.75 -19.98 6.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.224 -0.443 . . . . 73.219999999999999 111.085 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.838 HD12 HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -72.78 -44.58 61.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.171 -0.468 . . . . 72.209999999999994 110.92 179.963 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ASP . . . . . 0.487 ' HB2' HG22 ' A' ' 77' ' ' VAL . 9.9 t0 -48.54 -29.45 4.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 72.409999999999997 110.794 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -91.78 -30.16 16.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.465 . . . . 73.219999999999999 110.894 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.618 ' O ' HD13 ' A' ' 120' ' ' LEU . 19.1 m-70 -128.06 98.37 27.2 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.552 0.692 . . . . 61.530000000000001 110.857 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.535 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.4 Cg_endo -69.8 3.93 2.51 Favored 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.652 2.235 . . . . 63.340000000000003 112.357 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -115.2 -12.58 11.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.257 -0.429 . . . . 74.540000000000006 110.878 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.785 HD13 HG23 ' A' ' 119' ' ' VAL . 2.1 mt -50.42 -48.53 56.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 71.219999999999999 110.924 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.728 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.67 -29.47 7.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 64.0 110.978 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.476 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 6.9 m120 -86.85 -26.9 23.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 73.409999999999997 110.902 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.437 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.9 OUTLIER -96.89 7.81 45.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 71.439999999999998 110.885 -180.0 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.712 HD12 ' HG ' ' A' ' 116' ' ' LEU . 7.8 pt -128.06 -34.32 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 75.140000000000001 111.103 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.476 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 0.9 OUTLIER . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.253 -0.431 . . . . 65.420000000000002 110.858 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.594 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 1.4 mmt . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.893 0.378 . . . . 71.030000000000001 110.883 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.66 -169.2 0.41 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 75.439999999999998 110.893 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.1 p 177.64 58.39 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.641 0.734 . . . . 43.340000000000003 110.844 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 1.94 3.95 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.71 2.274 . . . . 71.420000000000002 112.348 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.604 HG21 ' CD ' ' A' ' 42' ' ' GLU . 23.8 m -92.78 -37.28 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 73.209999999999994 111.184 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -127.26 -33.46 2.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.155 -0.475 . . . . 61.32 110.88 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 66.4 57.67 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 72.329999999999998 110.806 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 93.4 mm-40 -121.3 -75.92 0.59 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.224 -0.444 . . . . 75.219999999999999 110.914 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -99.09 -114.74 3.55 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.682 -0.771 . . . . 52.109999999999999 112.477 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.594 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 7.6 pt-20 -174.3 98.07 0.1 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.803 0.335 . . . . 70.420000000000002 110.866 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.561 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -59.63 107.4 0.59 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.201 -0.454 . . . . 75.519999999999996 110.824 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 6.6 p -146.7 127.44 6.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 64.129999999999995 111.157 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.606 ' N ' HD23 ' A' ' 35' ' ' LEU . 5.8 p -48.61 135.81 14.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.449 . . . . 73.310000000000002 110.86 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.435 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 174.41 77.29 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.784 -0.722 . . . . 74.040000000000006 112.531 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.435 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.7 OUTLIER -33.71 141.35 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.897 0.379 . . . . 74.439999999999998 111.102 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.17 -168.14 2.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.441 . . . . 73.340000000000003 110.939 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -93.2 116.25 28.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.271 -0.422 . . . . 75.120000000000005 110.913 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.78 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.6 mm -107.91 91.27 7.44 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.653 0.739 . . . . 71.030000000000001 111.058 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.477 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 54.4 Cg_endo -69.71 103.85 1.22 Allowed 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.688 2.258 . . . . 61.100000000000001 112.379 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -68.72 -34.2 75.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 63.409999999999997 110.926 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.529 HG21 ' HG2' ' A' ' 25' ' ' ARG . 27.5 m -128.05 147.37 50.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.107 -0.497 . . . . 61.119999999999997 111.077 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -141.62 47.78 1.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 73.400000000000006 110.91 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.18 -68.7 0.55 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.116 -0.493 . . . . 71.450000000000003 110.863 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -132.32 -42.92 0.17 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.708 -0.758 . . . . 64.209999999999994 112.404 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.529 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -102.05 40.46 1.33 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.842 0.353 . . . . 74.319999999999993 110.87 -179.803 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.41 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 8.7 tttm -50.08 113.9 0.97 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 73.319999999999993 110.91 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.577 HG21 ' CD2' ' A' ' 60' ' ' PHE . 2.1 t -134.65 94.76 3.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 73.420000000000002 111.151 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.477 ' HA ' ' HA ' ' A' ' 19' ' ' PRO . 0.8 OUTLIER -82.15 140.29 16.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 73.310000000000002 111.122 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.78 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -86.46 63.32 7.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 62.310000000000002 110.983 179.929 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -41.6 105.22 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 71.219999999999999 110.852 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.522 ' O ' HD13 ' A' ' 32' ' ' ILE . . . 115.37 62.46 0.37 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.737 -0.744 . . . . 72.209999999999994 112.516 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.618 HD11 ' CB ' ' A' ' 29' ' ' LEU . 19.9 mm -118.05 93.3 2.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.827 0.346 . . . . 61.5 111.147 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.81 152.3 38.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 61.350000000000001 110.907 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.58 -109.42 0.34 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.689 -0.767 . . . . 52.539999999999999 112.46 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.741 HD12 ' HB ' ' A' ' 44' ' ' ILE . 51.6 mt -156.76 86.31 0.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.805 0.336 . . . . 71.400000000000006 110.881 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.47 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.77 159.85 30.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 74.140000000000001 110.922 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 32.3 t -164.05 -46.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.088 -0.505 . . . . 73.400000000000006 110.92 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.0 m -120.37 -47.05 2.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.198 -0.455 . . . . 53.439999999999998 111.105 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -87.96 171.45 10.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 71.530000000000001 110.811 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -137.64 9.99 2.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.218 -0.446 . . . . 74.129999999999995 110.878 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -99.24 -62.73 1.2 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 54.200000000000003 110.89 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.604 ' CD ' HG21 ' A' ' 5' ' ' VAL . 14.4 tp10 -76.95 61.56 1.97 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 65.019999999999996 110.866 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.1 p -99.54 158.94 15.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 74.120000000000005 110.835 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.741 ' HB ' HD12 ' A' ' 35' ' ' LEU . 22.8 mm -140.95 139.75 33.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.153 -0.476 . . . . 74.120000000000005 111.17 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.7 mtm -145.87 131.82 19.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 73.230000000000004 110.902 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 44.0 m-20 -84.06 -169.78 2.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 64.129999999999995 110.857 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.19 -58.24 8.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 53.329999999999998 110.873 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.1 -55.8 24.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.191 -0.459 . . . . 74.319999999999993 110.867 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.47 -58.97 4.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 70.329999999999998 110.87 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.3 t -55.42 -38.41 68.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.15 -0.477 . . . . 71.310000000000002 110.826 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.09 -45.81 89.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 72.140000000000001 110.821 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.3 -58.12 6.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 63.450000000000003 111.159 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -54.02 -46.88 71.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 75.510000000000005 110.892 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.411 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -64.67 -50.52 66.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.125 -0.489 . . . . 72.25 110.883 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.39 -39.63 57.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.255 -0.43 . . . . 62.539999999999999 111.128 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.754 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -71.94 -67.56 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.248 -0.433 . . . . 50.130000000000003 110.847 -179.893 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.467 HG23 ' N ' ' A' ' 58' ' ' LYS . 21.9 m -46.77 -41.88 5.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 74.129999999999995 111.148 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.467 ' N ' HG23 ' A' ' 57' ' ' VAL . 10.0 mmmm -65.94 -50.83 62.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.246 -0.433 . . . . 73.219999999999999 110.89 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.43 -52.28 39.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 72.219999999999999 111.128 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.611 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -66.45 -42.67 87.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 72.140000000000001 110.869 -179.9 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 31.4 mtp85 -50.09 -52.98 30.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.154 -0.475 . . . . 72.019999999999996 110.892 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.26 -53.79 32.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 75.129999999999995 111.138 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.0 -39.48 26.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.293 -0.412 . . . . 54.299999999999997 110.813 -179.805 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 60' ' ' PHE . 60.3 t -80.7 -28.13 11.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 72.400000000000006 111.088 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 74.219999999999999 110.877 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 16.5 m . . . . . 0 C--O 1.23 0.053 0 CA-C-O 120.862 0.363 . . . . 73.319999999999993 111.128 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.559 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -105.57 159.75 28.43 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.653 0.74 . . . . 43.119999999999997 111.162 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.559 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.3 Cg_endo -69.76 -8.12 22.8 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.699 2.266 . . . . 72.519999999999996 112.356 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -97.69 -35.33 10.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 71.530000000000001 110.853 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -57.43 -60.02 4.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 71.329999999999998 110.874 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.895 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -45.74 -68.41 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.18 -0.463 . . . . 74.209999999999994 111.124 -179.965 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -48.2 -39.51 9.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.435 . . . . 71.120000000000005 111.166 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -60.18 -47.51 85.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.438 . . . . 74.409999999999997 110.875 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.562 HG22 ' HB2' ' A' ' 121' ' ' ASP . 95.0 t -60.49 -38.82 79.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 74.5 111.168 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.528 HH22 HG21 ' A' ' 113' ' ' THR . 0.4 OUTLIER -63.66 -60.05 3.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 54.240000000000002 110.939 -179.991 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.31 -21.22 66.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.475 . . . . 74.109999999999999 110.899 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -70.32 -54.2 13.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.267 -0.424 . . . . 71.230000000000004 110.918 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.816 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.1 mt -91.29 14.84 13.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 64.349999999999994 110.931 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 30.5 m 53.89 37.52 26.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.159 -0.473 . . . . 54.039999999999999 110.869 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.816 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.8 mm? -79.69 83.82 5.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 70.209999999999994 110.912 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.604 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.19 157.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 63.520000000000003 111.137 179.906 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -56.45 -23.13 36.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.219 -0.446 . . . . 75.239999999999995 110.885 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.63 -48.54 13.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 73.010000000000005 110.916 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.604 ' H ' HG23 ' A' ' 84' ' ' THR . 43.4 tt0 -61.63 -55.72 27.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.218 -0.447 . . . . 64.099999999999994 110.892 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.428 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -49.15 -32.45 10.1 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.184 -0.462 . . . . 73.150000000000006 111.087 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 5.6 p -80.54 -35.19 34.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 62.399999999999999 110.86 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -73.09 -23.7 60.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.084 -0.507 . . . . 63.229999999999997 110.846 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.77 HG23 ' HB3' ' A' ' 131' ' ' ARG . 19.3 mm -105.19 -63.02 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 61.130000000000003 111.09 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.576 ' HB3' HG23 ' A' ' 113' ' ' THR . 3.8 m-85 -74.62 -64.36 1.05 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.228 -0.442 . . . . 75.430000000000007 110.911 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 116.78 47.56 0.48 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.706 -0.759 . . . . 44.310000000000002 112.459 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -67.42 -35.34 87.01 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.768 -0.73 . . . . 41.520000000000003 112.443 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.31 -119.4 5.67 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.756 -0.735 . . . . 71.530000000000001 112.541 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 97' ' ' ASN . 0.1 OUTLIER -120.46 -61.57 2.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.859 0.362 . . . . 62.219999999999999 111.056 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.48 ' N ' HG22 ' A' ' 96' ' ' VAL . 1.0 OUTLIER -86.15 43.97 1.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.198 -0.455 . . . . 71.140000000000001 110.912 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.29 -75.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.144 -0.48 . . . . 55.140000000000001 111.125 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -41.81 -39.88 1.89 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 75.239999999999995 110.837 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.2 m -59.95 -76.22 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.116 -0.493 . . . . 74.310000000000002 110.836 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.622 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 30.1 mtt180 -50.34 -44.66 54.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 64.230000000000004 110.884 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.725 ' HB3' HD12 ' A' ' 74' ' ' ILE . 8.2 m-85 -55.86 -37.21 68.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 64.349999999999994 110.937 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -51.8 -29.26 18.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.1 -0.5 . . . . 74.530000000000001 110.867 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -107.16 -22.25 12.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 61.219999999999999 110.922 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.39 27.0 9.53 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.664 -0.779 . . . . 73.049999999999997 112.462 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 -98.34 -6.64 30.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.842 0.353 . . . . 71.230000000000004 110.843 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.622 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -110.51 10.57 23.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 22.02 111.123 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.45 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.9 pt20 -124.19 57.2 13.02 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.579 0.704 . . . . 71.140000000000001 110.91 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.523 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.9 Cg_endo -69.74 35.87 0.22 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.635 2.223 . . . . 64.450000000000003 112.408 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.762 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER 73.67 32.56 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.634 0.731 . . . . 74.340000000000003 110.894 179.934 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.762 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.0 Cg_endo -69.72 -164.02 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.721 2.28 . . . . 74.129999999999995 112.351 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.32 -30.95 21.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.473 . . . . 63.140000000000001 110.852 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.739 HG22 ' CD1' ' A' ' 117' ' ' LEU . 74.7 m -53.48 -48.08 69.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 73.420000000000002 111.101 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.411 HD11 ' HB2' ' A' ' 108' ' ' GLN . 40.2 mm -55.19 -46.27 77.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.45 . . . . 62.530000000000001 111.189 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.505 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -63.39 -29.14 70.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.149 -0.478 . . . . 73.219999999999999 110.894 179.831 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.549 ' CD2' HD12 ' A' ' 130' ' ' ILE . 6.4 mp -79.69 -42.45 24.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.203 -0.453 . . . . 74.040000000000006 110.862 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.895 HD13 HG22 ' A' ' 74' ' ' ILE . 3.8 mt -61.19 -49.71 76.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.451 . . . . 65.230000000000004 110.863 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.558 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.3 ptp180 -52.85 -37.22 59.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 60.539999999999999 110.859 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.558 HG13 ' HG3' ' A' ' 118' ' ' ARG . 32.8 m -90.87 -11.35 9.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.222 -0.445 . . . . 73.219999999999999 111.108 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.743 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -81.71 -40.23 23.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 72.209999999999994 110.912 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ASP . . . . . 0.562 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.5 OUTLIER -50.44 -30.23 12.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 72.409999999999997 110.872 179.864 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -98.09 -19.26 18.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 73.219999999999999 110.876 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.743 ' O ' HD13 ' A' ' 120' ' ' LEU . 57.1 m-70 -129.64 88.89 48.35 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.607 0.718 . . . . 61.530000000000001 110.917 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.692 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.7 Cg_endo -69.75 2.17 3.77 Favored 'Trans proline' 0 N--CA 1.466 -0.13 0 C-N-CA 122.68 2.253 . . . . 63.340000000000003 112.351 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -115.75 -12.59 11.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 74.540000000000006 110.872 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.658 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.7 tp -54.26 -46.46 72.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 71.219999999999999 110.892 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.442 ' HB3' HD11 ' A' ' 120' ' ' LEU . 0.9 OUTLIER -48.61 -30.62 5.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.165 -0.47 . . . . 64.0 110.896 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.62 HD21 HH12 ' A' ' 131' ' ' ARG . 6.4 m120 -85.19 -31.06 23.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 73.409999999999997 110.889 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.424 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.9 OUTLIER -89.75 4.41 49.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 71.439999999999998 110.86 -179.948 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.658 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.8 pt -123.63 -34.84 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.477 . . . . 75.140000000000001 111.157 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.77 ' HB3' HG23 ' A' ' 91' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 65.420000000000002 110.873 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.446 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.85 0.357 . . . . 71.030000000000001 110.895 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.43 -169.71 0.46 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.261 -0.427 . . . . 75.439999999999998 110.871 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.417 ' O ' ' N ' ' A' ' 7' ' ' HIS . 1.9 p 176.7 59.42 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.61 0.719 . . . . 43.340000000000003 110.937 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.7 1.74 4.13 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.664 2.242 . . . . 71.420000000000002 112.371 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.596 HG21 ' CD ' ' A' ' 42' ' ' GLU . 22.8 m -92.93 -37.35 8.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 73.209999999999994 111.148 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -127.0 -33.52 2.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 61.32 110.878 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.417 ' N ' ' O ' ' A' ' 3' ' ' CYS . 15.9 m-70 66.6 57.56 0.68 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.23 -0.441 . . . . 72.329999999999998 110.84 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -123.49 -75.78 0.6 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.278 -0.419 . . . . 75.219999999999999 110.869 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.56 -116.05 3.02 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.783 -0.722 . . . . 52.109999999999999 112.484 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.446 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 8.0 pt-20 -176.65 94.82 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.768 0.318 . . . . 70.420000000000002 110.929 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.597 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.3 ptp -54.62 106.19 0.2 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 75.519999999999996 110.809 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.442 HG12 ' O ' ' A' ' 10' ' ' GLU . 4.2 p -143.27 124.44 10.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 64.129999999999995 111.128 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.614 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.1 p -48.75 132.05 17.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 73.310000000000002 110.897 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.409 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.98 81.93 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.763 -0.732 . . . . 74.040000000000006 112.516 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.414 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -36.88 146.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.848 0.356 . . . . 74.439999999999998 111.154 -179.933 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.86 -165.51 1.65 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.183 -0.462 . . . . 73.340000000000003 110.94 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.682 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -95.19 116.76 29.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 75.120000000000005 110.871 179.841 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.718 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.1 mm -107.52 92.89 9.07 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.687 0.756 . . . . 71.030000000000001 111.112 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.411 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.4 Cg_endo -69.85 97.1 0.63 Allowed 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.651 2.234 . . . . 61.100000000000001 112.343 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.432 ' HB3' HG23 ' A' ' 27' ' ' THR . 18.5 t80 -62.94 -38.54 91.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 63.409999999999997 110.899 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.478 HG21 ' HG2' ' A' ' 25' ' ' ARG . 17.0 m -128.91 144.53 51.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 61.119999999999997 111.167 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -133.89 43.43 2.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.282 -0.417 . . . . 73.400000000000006 110.916 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.47 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -129.28 -68.38 0.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.154 -0.476 . . . . 71.450000000000003 110.884 -179.907 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -136.53 -46.04 0.08 OUTLIER Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.674 -0.774 . . . . 64.209999999999994 112.47 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.478 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.32 39.77 1.09 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.857 0.361 . . . . 74.319999999999993 110.885 -179.895 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.401 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 12.7 tttt -52.32 115.42 1.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 73.319999999999993 110.931 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.432 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -129.06 93.32 3.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.261 -0.427 . . . . 73.420000000000002 111.13 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.682 HG11 ' HB2' ' A' ' 17' ' ' ASP . 46.4 t -76.63 127.53 37.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.449 . . . . 73.310000000000002 111.117 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.741 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.71 51.22 2.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 62.310000000000002 110.95 179.945 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.2 mttp -37.74 107.64 0.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 71.219999999999999 110.88 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.67 47.46 0.4 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.791 -0.718 . . . . 72.209999999999994 112.497 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.58 HD11 ' HB3' ' A' ' 29' ' ' LEU . 16.7 mm -107.93 92.12 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.799 0.333 . . . . 61.5 111.2 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.05 154.07 38.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.456 . . . . 61.350000000000001 110.868 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.25 -107.8 0.29 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.708 -0.758 . . . . 52.539999999999999 112.493 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.757 HD12 ' HB ' ' A' ' 44' ' ' ILE . 45.1 mt -156.99 87.23 0.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.743 0.306 . . . . 71.400000000000006 110.856 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.434 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -162.62 159.47 24.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.195 -0.457 . . . . 74.140000000000001 110.929 179.941 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 36.1 t -168.56 -38.86 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.078 -0.51 . . . . 73.400000000000006 110.881 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.404 HG13 ' N ' ' A' ' 39' ' ' HIS . 2.5 p -124.05 -47.02 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 53.439999999999998 111.146 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.404 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -91.1 171.76 9.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 71.530000000000001 110.891 179.924 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.8 p -137.3 9.58 2.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 74.129999999999995 110.831 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -100.38 -62.67 1.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 54.200000000000003 110.926 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.596 ' CD ' HG21 ' A' ' 5' ' ' VAL . 13.4 tp10 -76.73 61.68 1.89 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 65.019999999999996 110.865 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.4 p -99.08 159.5 14.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 74.120000000000005 110.881 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.757 ' HB ' HD12 ' A' ' 35' ' ' LEU . 21.3 mm -143.85 140.06 25.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 74.120000000000005 111.121 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.7 mtt -143.27 135.11 26.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.439 . . . . 73.230000000000004 110.859 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -86.89 -169.5 2.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.187 -0.46 . . . . 64.129999999999995 110.921 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.83 -60.87 2.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.166 -0.47 . . . . 53.329999999999998 110.961 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -52.29 -57.07 10.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 74.319999999999993 110.843 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -50.84 -58.98 4.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 70.329999999999998 110.894 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.8 t -53.89 -40.97 67.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 71.310000000000002 110.865 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.93 -44.73 87.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.148 -0.478 . . . . 72.140000000000001 110.889 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.72 -60.45 3.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.456 . . . . 63.450000000000003 111.034 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.436 ' CZ ' HG11 ' A' ' 57' ' ' VAL . 20.6 t80 -53.56 -47.51 69.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 75.510000000000005 110.936 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.43 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.75 -48.36 79.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 72.25 110.874 179.925 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.45 -42.9 64.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 62.539999999999999 111.01 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.741 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -69.55 -66.16 0.62 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 50.130000000000003 110.968 -179.905 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.436 HG11 ' CZ ' ' A' ' 53' ' ' PHE . 17.9 m -47.3 -35.94 3.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.241 -0.436 . . . . 74.129999999999995 111.083 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 mmmt -69.79 -51.32 34.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.201 -0.454 . . . . 73.219999999999999 110.865 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.97 -52.04 53.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.447 . . . . 72.219999999999999 111.163 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.635 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.2 OUTLIER -65.41 -46.1 81.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 72.140000000000001 110.863 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.93 -52.39 33.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.107 -0.497 . . . . 72.019999999999996 110.85 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.87 -54.41 35.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 75.129999999999995 111.119 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.06 -41.19 34.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.221 -0.445 . . . . 54.299999999999997 110.867 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 60' ' ' PHE . 41.9 t -78.86 -27.15 13.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.081 -0.509 . . . . 72.400000000000006 111.096 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 74.219999999999999 110.915 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 19.1 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.793 0.33 . . . . 73.319999999999993 111.127 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.509 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -104.22 158.18 32.47 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.639 0.733 . . . . 43.119999999999997 111.091 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.564 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.6 Cg_endo -69.7 -7.46 21.09 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.668 2.245 . . . . 72.519999999999996 112.377 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -96.43 -39.1 9.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.158 -0.473 . . . . 71.530000000000001 110.943 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.429 ' CE1' ' HA ' ' A' ' 118' ' ' ARG . 11.8 t80 -55.31 -60.2 3.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.106 -0.497 . . . . 71.329999999999998 110.854 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.623 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -45.67 -69.72 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 74.209999999999994 111.15 -179.999 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.1 m -47.76 -38.01 6.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.129 -0.487 . . . . 71.120000000000005 111.151 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.1 mtmt -61.47 -45.79 92.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 74.409999999999997 110.886 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.626 HG22 ' HB2' ' A' ' 121' ' ' ASP . 69.5 t -61.93 -38.33 80.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 74.5 111.091 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.438 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -65.25 -56.61 11.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.28 -0.418 . . . . 54.240000000000002 110.822 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.6 pttt -67.17 -21.24 65.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.253 -0.431 . . . . 74.109999999999999 110.912 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -71.39 -53.24 14.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 71.230000000000004 110.871 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.836 ' HB2' HD23 ' A' ' 83' ' ' LEU . 14.1 mt -91.63 14.99 13.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.238 -0.437 . . . . 64.349999999999994 110.943 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.3 m 51.54 38.18 21.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 54.039999999999999 110.85 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.836 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.9 mm? -79.28 86.75 5.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 70.209999999999994 110.827 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.645 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.18 155.92 0.18 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 63.520000000000003 111.097 179.905 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -58.34 -21.65 50.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.173 -0.467 . . . . 75.239999999999995 110.91 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -80.68 -53.72 6.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 73.010000000000005 110.855 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.645 ' H ' HG23 ' A' ' 84' ' ' THR . 0.5 OUTLIER -63.08 -47.69 81.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 64.099999999999994 110.881 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.414 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -56.5 -32.53 65.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.119 -0.491 . . . . 73.150000000000006 111.028 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 26.3 p -80.57 -33.98 35.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.305 -0.407 . . . . 62.399999999999999 110.808 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -74.3 -25.7 59.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 63.229999999999997 110.881 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.726 ' CD1' HD12 ' A' ' 127' ' ' LEU . 49.7 mt -101.43 -59.76 3.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 61.130000000000003 111.132 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.551 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.7 m-85 -77.99 -62.86 1.54 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 75.430000000000007 110.86 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 111.98 50.39 0.59 Allowed Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.77 -0.728 . . . . 44.310000000000002 112.538 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -82.12 -44.61 7.49 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.772 -0.728 . . . . 41.520000000000003 112.525 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 109.96 167.33 19.82 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.724 -0.75 . . . . 71.530000000000001 112.461 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.502 HG13 ' N ' ' A' ' 97' ' ' ASN . 3.4 p -56.67 -50.62 73.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.845 0.355 . . . . 62.219999999999999 111.124 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.502 ' N ' HG13 ' A' ' 96' ' ' VAL . 12.0 p30 -86.18 33.99 0.62 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 71.140000000000001 110.934 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.407 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -64.26 -77.17 0.06 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 55.140000000000001 111.114 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.407 ' C ' ' O ' ' A' ' 98' ' ' ALA . 47.9 m-85 -37.75 -47.11 0.97 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 75.239999999999995 110.854 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.08 -75.39 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.149 -0.478 . . . . 74.310000000000002 110.916 -179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.548 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 17.2 mtt180 -46.82 -53.64 11.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.093 -0.503 . . . . 64.230000000000004 110.865 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.622 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.7 m-85 -49.6 -39.41 35.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 64.349999999999994 110.929 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -51.81 -40.55 60.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.114 -0.494 . . . . 74.530000000000001 110.913 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.18 -18.8 22.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.111 -0.495 . . . . 61.219999999999999 110.942 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.33 25.88 13.22 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.726 -0.749 . . . . 73.049999999999997 112.492 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -92.82 -28.65 16.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.847 0.356 . . . . 71.230000000000004 110.926 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.548 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -98.13 18.86 15.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 22.02 111.083 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.498 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -121.01 53.87 3.65 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.607 0.718 . . . . 71.140000000000001 110.913 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.5 Cg_endo -69.75 27.06 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.652 2.235 . . . . 64.450000000000003 112.374 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.731 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.8 m-70 70.87 36.02 0.1 Allowed Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 121.649 0.738 . . . . 74.340000000000003 110.919 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.731 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.3 Cg_endo -69.74 -165.28 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.608 2.205 . . . . 74.129999999999995 112.363 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 12.9 p -82.56 -32.72 28.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 63.140000000000001 110.882 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.551 HG23 ' HB3' ' A' ' 92' ' ' PHE . 17.3 m -49.02 -42.73 39.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 73.420000000000002 111.068 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.442 HD11 ' HG2' ' A' ' 108' ' ' GLN . 24.4 mm -60.76 -43.5 95.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.253 -0.431 . . . . 62.530000000000001 111.13 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.695 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -63.33 -29.67 70.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 73.219999999999999 110.929 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.695 HD12 ' HG3' ' A' ' 115' ' ' LYS . 8.1 mp -81.49 -47.61 12.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.236 -0.438 . . . . 74.040000000000006 110.9 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.623 HD13 HG22 ' A' ' 74' ' ' ILE . 34.9 mt -56.39 -47.81 78.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.448 . . . . 65.230000000000004 110.926 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.66 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.3 ptp180 -55.18 -36.09 65.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 60.539999999999999 110.815 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.66 HG13 ' HG3' ' A' ' 118' ' ' ARG . 19.9 m -95.91 0.22 10.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.287 -0.415 . . . . 73.219999999999999 111.15 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.754 HD12 HD13 ' A' ' 81' ' ' LEU . 0.5 OUTLIER -92.21 -38.29 12.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.105 -0.498 . . . . 72.209999999999994 110.915 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ASP . . . . . 0.626 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.3 OUTLIER -52.45 -24.4 7.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 72.409999999999997 110.844 179.841 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.502 ' HD3' ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -100.66 -20.37 15.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.244 -0.434 . . . . 73.219999999999999 110.942 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.732 ' O ' HD13 ' A' ' 120' ' ' LEU . 41.7 m80 -130.19 91.05 40.11 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.547 0.689 . . . . 61.530000000000001 110.935 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.673 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.8 Cg_endo -69.69 2.05 3.84 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.658 2.238 . . . . 63.340000000000003 112.326 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -116.45 -12.17 11.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.439 . . . . 74.540000000000006 110.924 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.653 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.8 tp -52.9 -47.4 67.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 71.219999999999999 110.955 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.726 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.8 pt? -49.7 -29.52 7.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.132 -0.485 . . . . 64.0 110.901 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.516 HD21 HH12 ' A' ' 131' ' ' ARG . 6.8 m120 -86.08 -28.41 24.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.46 . . . . 73.409999999999997 110.855 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.433 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -93.71 5.36 51.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 71.439999999999998 110.936 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.653 HG23 ' O ' ' A' ' 126' ' ' LEU . 11.4 pt -124.8 -35.18 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 75.140000000000001 111.145 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.516 HH12 HD21 ' A' ' 128' ' ' ASN . 1.6 ptt-85 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 65.420000000000002 110.859 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mmt . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.817 0.341 . . . . 71.030000000000001 110.852 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.34 -169.14 0.43 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 75.439999999999998 110.926 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.0 p -179.83 59.7 0.1 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.611 0.72 . . . . 43.340000000000003 110.925 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -4.51 14.18 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.684 2.256 . . . . 71.420000000000002 112.332 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.543 HG12 ' N ' ' A' ' 6' ' ' CYS . 2.1 t -74.43 -62.17 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 73.209999999999994 111.14 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.543 ' N ' HG12 ' A' ' 5' ' ' VAL . 49.4 t -120.14 -18.58 8.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 61.32 110.861 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 63.65 79.88 0.25 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.252 -0.431 . . . . 72.329999999999998 110.848 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -138.52 -75.49 0.38 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 75.219999999999999 110.952 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.636 ' HA3' HG13 ' A' ' 38' ' ' VAL . . . -98.05 -114.27 3.32 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.678 -0.773 . . . . 52.109999999999999 112.481 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.46 ' HG2' HG11 ' A' ' 38' ' ' VAL . 5.7 pt-20 -170.62 93.94 0.2 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.801 0.334 . . . . 70.420000000000002 110.945 -179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.564 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.7 OUTLIER -54.18 98.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 75.519999999999996 110.874 -179.934 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 15.0 p -144.32 131.02 16.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 64.129999999999995 111.087 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.515 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.3 OUTLIER -44.91 122.75 3.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 73.310000000000002 110.831 -179.875 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.76 81.58 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.713 -0.756 . . . . 74.040000000000006 112.509 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.418 HD12 ' N ' ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.89 148.38 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.862 0.363 . . . . 74.439999999999998 111.153 -179.98 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.42 -165.95 1.8 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 73.340000000000003 110.939 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.688 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -96.81 116.98 30.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 75.120000000000005 110.859 179.833 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.725 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.9 mm -107.74 91.78 7.91 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.548 0.689 . . . . 71.030000000000001 111.096 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.455 ' HA ' HG22 ' A' ' 28' ' ' VAL . 54.0 Cg_endo -69.77 96.29 0.59 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.658 2.239 . . . . 61.100000000000001 112.359 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.441 ' HB3' HG23 ' A' ' 27' ' ' THR . 16.5 t80 -63.32 -37.6 87.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 63.409999999999997 110.956 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.504 HG21 ' HG2' ' A' ' 25' ' ' ARG . 16.4 m -128.78 147.22 50.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.111 -0.495 . . . . 61.119999999999997 111.204 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -144.19 37.22 1.25 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 73.400000000000006 110.867 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.455 ' HD3' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -128.01 -39.74 1.73 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.193 -0.458 . . . . 71.450000000000003 110.897 -179.892 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -156.76 -58.82 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.67 -0.776 . . . . 64.209999999999994 112.441 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.504 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -90.92 46.77 1.35 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.869 0.366 . . . . 74.319999999999993 110.888 -179.836 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.417 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 10.8 tttm -53.74 116.31 2.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 73.319999999999993 110.923 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.441 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -131.58 92.2 3.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.305 -0.407 . . . . 73.420000000000002 111.186 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.688 HG11 ' HB2' ' A' ' 17' ' ' ASP . 42.8 t -76.61 127.55 37.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 73.310000000000002 111.127 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.74 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.79 51.51 2.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 62.310000000000002 110.893 179.934 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 20.2 mttp -38.99 107.33 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.215 -0.448 . . . . 71.219999999999999 110.888 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.67 44.91 0.4 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.75 -0.738 . . . . 72.209999999999994 112.496 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.587 HG22 ' OH ' ' A' ' 36' ' ' TYR . 14.3 mm -105.58 90.09 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.885 0.374 . . . . 61.5 111.17 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.77 156.62 37.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 61.350000000000001 110.857 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.34 -106.65 0.27 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.784 -0.722 . . . . 52.539999999999999 112.507 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.762 HD12 ' HB ' ' A' ' 44' ' ' ILE . 65.2 mt -155.61 83.95 1.04 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.781 0.324 . . . . 71.400000000000006 110.899 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.587 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -169.99 149.66 3.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.257 -0.429 . . . . 74.140000000000001 110.972 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.2 t -167.47 25.74 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.109 -0.496 . . . . 73.400000000000006 110.859 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.636 HG13 ' HA3' ' A' ' 9' ' ' GLY . 1.9 p 179.29 -34.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 53.439999999999998 111.138 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -113.79 176.2 5.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.195 -0.457 . . . . 71.530000000000001 110.795 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.58 24.57 1.38 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.485 . . . . 74.129999999999995 110.877 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -100.82 -77.42 0.54 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 54.200000000000003 110.895 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -78.28 60.75 2.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.475 . . . . 65.019999999999996 110.892 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.0 p -87.9 162.77 16.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 74.120000000000005 110.892 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.762 ' HB ' HD12 ' A' ' 35' ' ' LEU . 21.1 mm -146.99 139.3 19.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 74.120000000000005 111.044 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.2 mtt -142.67 146.02 34.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 73.230000000000004 110.869 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.5 m-20 -95.56 -169.09 1.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.158 -0.473 . . . . 64.129999999999995 110.88 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -55.12 -60.53 3.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 53.329999999999998 110.886 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -52.67 -57.95 8.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.436 . . . . 74.319999999999993 110.877 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.53 -59.35 4.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 70.329999999999998 110.834 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.6 t -52.82 -42.39 65.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.187 -0.46 . . . . 71.310000000000002 110.815 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.25 -44.34 83.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.129 -0.487 . . . . 72.140000000000001 110.899 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.89 -61.76 1.97 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 63.450000000000003 111.157 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.437 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.8 t80 -52.44 -46.87 66.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.25 -0.432 . . . . 75.510000000000005 110.855 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.449 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.34 -49.57 73.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 72.25 110.889 179.935 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.49 -42.12 61.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 62.539999999999999 111.035 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.74 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -70.32 -66.9 0.54 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.272 -0.422 . . . . 50.130000000000003 110.961 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.449 HG22 ' HA ' ' A' ' 54' ' ' MET . 16.6 m -46.95 -35.64 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.449 . . . . 74.129999999999995 111.109 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.8 mmmm -70.42 -51.95 25.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 73.219999999999999 110.912 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.26 -51.49 53.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.277 -0.42 . . . . 72.219999999999999 111.143 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.613 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -66.41 -45.81 78.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 72.140000000000001 110.935 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.35 -46.86 56.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 72.019999999999996 110.863 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.21 -57.52 5.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 75.129999999999995 111.078 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.26 -39.2 13.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 54.299999999999997 110.85 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 60' ' ' PHE . 46.0 t -80.59 -31.28 12.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 72.400000000000006 111.126 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 74.219999999999999 110.928 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.574 HG22 HE22 ' A' ' 108' ' ' GLN . 4.7 m . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.822 0.344 . . . . 73.319999999999993 111.095 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.469 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -92.83 157.49 39.42 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.509 0.671 . . . . 43.119999999999997 111.077 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.712 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.6 Cg_endo -69.76 -6.33 18.35 Favored 'Trans proline' 0 C--N 1.34 0.121 0 C-N-CA 122.669 2.246 . . . . 72.519999999999996 112.35 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -92.45 -44.6 8.58 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.23 -0.441 . . . . 71.530000000000001 110.834 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -52.9 -62.22 1.79 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 71.329999999999998 110.904 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.712 HD11 ' HA ' ' A' ' 71' ' ' PRO . 0.3 OUTLIER -44.63 -69.97 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.142 -0.481 . . . . 74.209999999999994 111.095 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 26.7 m -48.28 -39.17 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.175 -0.466 . . . . 71.120000000000005 111.12 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -59.68 -47.21 86.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 74.409999999999997 110.898 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.413 HG22 ' HB2' ' A' ' 121' ' ' ASP . 98.7 t -60.29 -39.4 80.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 74.5 111.146 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.577 HH22 HG21 ' A' ' 113' ' ' THR . 0.7 OUTLIER -64.06 -60.39 3.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 54.240000000000002 110.793 -179.875 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -63.89 -22.72 67.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.257 -0.429 . . . . 74.109999999999999 110.864 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 14.2 ttmm -68.18 -54.71 15.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.462 . . . . 71.230000000000004 110.904 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.847 ' HB2' HD23 ' A' ' 83' ' ' LEU . 9.2 mt -91.6 15.91 11.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.241 -0.436 . . . . 64.349999999999994 110.902 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.88 39.53 26.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 54.039999999999999 110.811 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.847 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.5 mm? -79.34 86.15 5.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.144 -0.48 . . . . 70.209999999999994 110.937 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.645 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -44.95 156.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.247 -0.433 . . . . 63.520000000000003 111.109 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -59.04 -20.6 54.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 75.239999999999995 110.951 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -81.35 -53.69 6.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 73.010000000000005 110.909 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.645 ' H ' HG23 ' A' ' 84' ' ' THR . 4.0 tt0 -59.57 -48.66 80.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.47 . . . . 64.099999999999994 110.81 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.45 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -56.12 -32.87 64.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.178 -0.465 . . . . 73.150000000000006 111.11 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 28.6 t -79.42 -31.63 42.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 62.399999999999999 110.828 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -79.47 -24.24 42.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 63.229999999999997 110.894 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.727 ' CD1' HD12 ' A' ' 127' ' ' LEU . 50.7 mt -103.61 -62.07 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.481 . . . . 61.130000000000003 111.158 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.541 ' HB3' HG23 ' A' ' 113' ' ' THR . 5.7 m-85 -75.31 -64.16 1.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.173 -0.467 . . . . 75.430000000000007 110.85 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 116.73 49.33 0.43 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.718 -0.753 . . . . 44.310000000000002 112.519 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -82.95 -45.39 6.7 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.701 -0.761 . . . . 41.520000000000003 112.434 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLY . . . . . 0.403 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 109.66 166.89 20.05 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.762 -0.733 . . . . 71.530000000000001 112.489 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.5 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.7 p -50.91 -51.69 19.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.827 0.346 . . . . 62.219999999999999 111.096 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.5 ' N ' HG13 ' A' ' 96' ' ' VAL . 28.2 m-20 -87.23 40.21 0.91 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 71.140000000000001 110.886 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.404 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -63.86 -78.22 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.226 -0.443 . . . . 55.140000000000001 111.073 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.404 ' C ' ' O ' ' A' ' 98' ' ' ALA . 40.6 m-85 -38.2 -42.55 0.69 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.165 -0.471 . . . . 75.239999999999995 110.932 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.0 t -60.02 -74.81 0.07 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.181 -0.463 . . . . 74.310000000000002 110.851 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.518 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 34.6 mtt85 -49.64 -46.8 49.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.164 -0.471 . . . . 64.230000000000004 110.931 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -56.63 -35.47 68.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.149 -0.478 . . . . 64.349999999999994 110.886 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -77.86 -3.77 43.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 74.530000000000001 110.894 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.2 -19.1 10.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 61.219999999999999 110.927 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.84 19.83 35.79 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.703 -0.761 . . . . 73.049999999999997 112.495 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -98.39 -29.51 13.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.764 0.316 . . . . 71.230000000000004 110.826 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.518 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -99.16 26.05 6.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 22.02 111.063 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.574 HE22 HG22 ' A' ' 69' ' ' VAL . 0.0 OUTLIER -126.37 47.51 2.44 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.606 0.717 . . . . 71.140000000000001 110.937 -179.982 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.553 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.4 Cg_endo -69.7 24.94 0.17 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.669 2.246 . . . . 64.450000000000003 112.333 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.736 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 15.2 t-160 69.98 35.15 0.1 OUTLIER Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.586 0.707 . . . . 74.340000000000003 110.857 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.736 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.2 Cg_endo -69.82 -165.31 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.711 2.274 . . . . 74.129999999999995 112.259 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.5 t -79.84 -29.86 40.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.161 -0.472 . . . . 63.140000000000001 110.882 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.577 HG21 HH22 ' A' ' 78' ' ' ARG . 39.7 m -52.41 -39.25 60.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.161 -0.472 . . . . 73.420000000000002 111.184 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.517 HD11 ' HG2' ' A' ' 108' ' ' GLN . 33.1 mm -63.45 -44.3 98.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.456 . . . . 62.530000000000001 111.138 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.708 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -65.16 -29.16 69.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.128 -0.487 . . . . 73.219999999999999 110.858 179.871 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.708 HD12 ' HG3' ' A' ' 115' ' ' LYS . 8.1 mp -81.94 -44.93 16.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.277 -0.42 . . . . 74.040000000000006 110.916 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.503 ' CD1' HG22 ' A' ' 113' ' ' THR . 39.8 mt -59.59 -48.27 82.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.456 . . . . 65.230000000000004 110.856 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.598 ' HG3' HG13 ' A' ' 119' ' ' VAL . 14.3 ptp180 -54.11 -37.61 64.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.228 -0.442 . . . . 60.539999999999999 110.928 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.598 HG13 ' HG3' ' A' ' 118' ' ' ARG . 27.4 m -91.88 -8.6 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 73.219999999999999 111.095 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.739 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -83.24 -40.06 20.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 72.209999999999994 110.917 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ASP . . . . . 0.413 ' HB2' HG22 ' A' ' 77' ' ' VAL . 12.5 t0 -49.72 -31.31 11.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 72.409999999999997 110.873 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.93 -19.69 17.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 73.219999999999999 110.908 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.739 ' O ' HD13 ' A' ' 120' ' ' LEU . 34.9 m-70 -127.76 87.03 56.88 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.591 0.71 . . . . 61.530000000000001 110.875 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.707 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.9 Cg_endo -69.8 3.37 2.83 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.703 2.269 . . . . 63.340000000000003 112.35 180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -116.97 -12.7 10.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 74.540000000000006 110.92 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.663 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.1 tp -53.97 -46.68 71.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.466 . . . . 71.219999999999999 110.941 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.727 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.65 -29.43 7.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.459 . . . . 64.0 110.912 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.498 HD21 HH12 ' A' ' 131' ' ' ARG . 6.4 m120 -86.56 -27.93 23.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 73.409999999999997 110.864 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.428 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -94.15 4.96 53.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 71.439999999999998 110.955 179.941 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 126' ' ' LEU . 11.7 pt -124.24 -35.01 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 75.140000000000001 111.139 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.498 HH12 HD21 ' A' ' 128' ' ' ASN . 1.4 ptt-85 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 65.420000000000002 110.922 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.613 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.849 0.357 . . . . 71.030000000000001 110.949 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.75 -170.39 0.48 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 75.439999999999998 110.905 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 p 178.99 56.96 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.555 0.693 . . . . 43.340000000000003 110.904 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.403 ' HA ' ' CD2' ' A' ' 7' ' ' HIS . 53.4 Cg_endo -69.73 7.28 1.02 Allowed 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.658 2.239 . . . . 71.420000000000002 112.381 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.5 m -102.27 -43.3 9.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 73.209999999999994 111.114 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.9 -31.92 4.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.192 -0.458 . . . . 61.32 110.915 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.403 ' CD2' ' HA ' ' A' ' 4' ' ' PRO . 4.0 m-70 63.5 49.06 3.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.148 -0.478 . . . . 72.329999999999998 110.859 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 72.6 mm-40 -117.13 -75.6 0.58 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 75.219999999999999 110.881 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -93.76 -117.14 2.71 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.728 -0.749 . . . . 52.109999999999999 112.561 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.613 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 8.0 pt-20 -174.08 93.27 0.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.857 0.36 . . . . 70.420000000000002 110.887 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.54 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.2 ptp -52.65 106.1 0.15 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 75.519999999999996 110.931 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.428 HG12 ' O ' ' A' ' 10' ' ' GLU . 7.5 p -147.41 127.81 5.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.238 -0.437 . . . . 64.129999999999995 111.176 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.574 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -45.38 127.45 7.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 73.310000000000002 110.864 -179.781 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.95 81.74 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.741 -0.742 . . . . 74.040000000000006 112.467 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.412 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.38 147.34 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.887 0.375 . . . . 74.439999999999998 111.12 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.32 -165.77 1.77 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 73.340000000000003 110.906 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.672 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -96.38 116.66 29.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 75.120000000000005 110.856 179.918 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.698 ' O ' HD22 ' A' ' 29' ' ' LEU . 10.0 mm -107.62 92.44 8.62 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.644 0.735 . . . . 71.030000000000001 111.138 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.434 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.9 Cg_endo -69.78 96.88 0.61 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.688 2.259 . . . . 61.100000000000001 112.345 179.888 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.505 ' HB3' HG23 ' A' ' 27' ' ' THR . 18.3 t80 -62.65 -38.45 90.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 63.409999999999997 110.93 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.521 HG21 ' HG2' ' A' ' 25' ' ' ARG . 16.8 m -129.04 145.38 51.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.071 -0.513 . . . . 61.119999999999997 111.125 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -135.48 46.51 2.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 73.400000000000006 110.886 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.423 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -131.79 -68.39 0.64 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.163 -0.471 . . . . 71.450000000000003 110.908 -179.915 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -137.21 -42.71 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.718 -0.754 . . . . 64.209999999999994 112.463 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.521 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -98.03 39.4 1.23 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.852 0.358 . . . . 74.319999999999993 110.865 -179.883 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.407 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 12.8 tttm -51.64 117.27 2.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.287 -0.415 . . . . 73.319999999999993 110.915 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.505 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -129.66 92.15 3.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.257 -0.429 . . . . 73.420000000000002 111.119 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.672 HG11 ' HB2' ' A' ' 17' ' ' ASP . 40.4 t -76.77 127.18 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 73.310000000000002 111.189 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.76 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.83 51.92 2.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.474 . . . . 62.310000000000002 110.885 -179.993 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.1 mttm -39.14 106.94 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 71.219999999999999 110.899 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.91 45.3 0.38 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.795 -0.717 . . . . 72.209999999999994 112.498 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.575 HG22 ' OH ' ' A' ' 36' ' ' TYR . 14.4 mm -105.93 91.3 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.834 0.35 . . . . 61.5 111.195 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.85 158.59 33.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.246 -0.434 . . . . 61.350000000000001 110.848 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 163.11 -105.99 0.27 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.709 -0.758 . . . . 52.539999999999999 112.45 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.742 HD12 ' HB ' ' A' ' 44' ' ' ILE . 46.9 mt -156.67 83.4 0.96 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.789 0.328 . . . . 71.400000000000006 110.952 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.575 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -168.96 169.44 9.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.204 -0.453 . . . . 74.140000000000001 110.906 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.51 -33.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.061 -0.518 . . . . 73.400000000000006 110.909 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 p -120.23 -45.76 2.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 53.439999999999998 111.098 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -99.4 178.44 4.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 71.530000000000001 110.821 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 24.1 p -148.88 29.95 0.81 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.206 -0.452 . . . . 74.129999999999995 110.887 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -104.52 -77.27 0.58 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.453 . . . . 54.200000000000003 110.865 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -77.55 59.95 2.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.504 . . . . 65.019999999999996 110.881 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.7 p -83.74 158.88 21.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 74.120000000000005 110.832 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.742 ' HB ' HD12 ' A' ' 35' ' ' LEU . 28.1 mm -144.34 140.81 24.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.1 -0.5 . . . . 74.120000000000005 111.08 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.9 mtt -144.76 142.38 29.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.136 -0.484 . . . . 73.230000000000004 110.834 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.0 m-20 -90.76 -172.96 3.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 64.129999999999995 110.894 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.52 -62.1 1.84 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.47 . . . . 53.329999999999998 110.932 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -51.05 -58.17 6.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.155 -0.475 . . . . 74.319999999999993 110.885 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -49.13 -59.12 3.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 70.329999999999998 110.861 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.9 t -53.46 -42.05 66.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 71.310000000000002 110.895 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.24 -44.1 83.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.136 -0.484 . . . . 72.140000000000001 110.867 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.33 -61.37 2.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 63.450000000000003 111.048 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.455 ' CZ ' HG11 ' A' ' 57' ' ' VAL . 19.4 t80 -52.83 -46.66 67.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 75.510000000000005 110.873 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.43 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.55 -49.61 72.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.49 . . . . 72.25 110.853 180.0 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.61 -42.77 62.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.276 -0.42 . . . . 62.539999999999999 111.033 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.76 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -70.04 -66.79 0.55 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 50.130000000000003 110.879 -179.89 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.455 HG11 ' CZ ' ' A' ' 53' ' ' PHE . 17.7 m -46.68 -35.63 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 74.129999999999995 111.134 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -70.56 -51.01 31.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.468 . . . . 73.219999999999999 110.857 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.74 -51.18 58.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.302 -0.408 . . . . 72.219999999999999 111.038 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.607 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -67.34 -45.09 77.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.25 -0.432 . . . . 72.140000000000001 110.894 -179.898 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 -50.63 -50.55 53.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.177 -0.465 . . . . 72.019999999999996 110.88 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.24 -56.26 12.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.452 . . . . 75.129999999999995 111.156 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -46.67 -42.99 17.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 54.299999999999997 110.892 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 60' ' ' PHE . 57.3 t -74.09 -34.33 38.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 72.400000000000006 111.146 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.219999999999999 110.882 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 15.7 m . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.856 0.36 . . . . 73.319999999999993 111.145 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -102.99 154.14 37.77 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.601 0.715 . . . . 43.119999999999997 111.118 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.597 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.6 Cg_endo -69.74 -7.67 21.65 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.721 2.281 . . . . 72.519999999999996 112.31 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -95.98 -38.92 10.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 71.530000000000001 110.88 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.531 ' O ' HG23 ' A' ' 77' ' ' VAL . 12.3 t80 -56.23 -59.98 4.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.49 . . . . 71.329999999999998 110.9 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.775 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -45.22 -68.79 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.104 -0.498 . . . . 74.209999999999994 111.16 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.6 m -48.75 -39.1 10.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 71.120000000000005 111.144 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -61.04 -38.19 85.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 74.409999999999997 110.875 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 73' ' ' PHE . 55.2 t -70.88 -37.15 67.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.247 -0.433 . . . . 74.5 111.163 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.6 OUTLIER -70.81 -33.16 70.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 54.240000000000002 110.857 -179.94 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.37 -20.1 24.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.195 -0.457 . . . . 74.109999999999999 110.936 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.474 ' HG2' HD23 ' A' ' 81' ' ' LEU . 1.2 ttmm -76.19 -51.5 11.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 71.230000000000004 110.956 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.812 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.3 mt -89.89 13.56 14.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.237 -0.438 . . . . 64.349999999999994 110.914 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.24 42.16 28.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 54.039999999999999 110.953 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.812 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.4 mm? -78.73 85.03 4.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.041 -0.527 . . . . 70.209999999999994 110.904 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.632 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.22 156.66 0.15 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.124 -0.489 . . . . 63.520000000000003 111.086 179.947 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -57.64 -23.01 48.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 75.239999999999995 110.911 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.0 mttm -79.47 -53.29 7.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 73.010000000000005 110.904 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.632 ' H ' HG23 ' A' ' 84' ' ' THR . 3.0 tt0 -63.66 -53.72 47.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 64.099999999999994 110.905 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.559 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -53.65 -36.31 61.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.087 -0.506 . . . . 73.150000000000006 111.147 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.7 t -79.01 -28.81 43.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 62.399999999999999 110.824 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -78.08 -29.56 49.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.108 -0.496 . . . . 63.229999999999997 110.885 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.77 HD12 ' HB3' ' A' ' 131' ' ' ARG . 18.3 mm -98.8 -58.24 3.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.096 -0.502 . . . . 61.130000000000003 111.18 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.547 ' HB3' HG23 ' A' ' 113' ' ' THR . 5.5 m-85 -77.11 -64.36 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 75.430000000000007 110.842 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 110.54 45.37 0.91 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.786 -0.721 . . . . 44.310000000000002 112.479 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.71 -45.04 93.95 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.67 -0.776 . . . . 41.520000000000003 112.513 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.04 172.23 21.75 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.72 -0.752 . . . . 71.530000000000001 112.464 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.675 HG13 ' H ' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -50.53 -66.52 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.873 0.368 . . . . 62.219999999999999 111.161 -179.992 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.675 ' H ' HG13 ' A' ' 96' ' ' VAL . 8.4 t30 -86.21 42.4 0.99 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.471 . . . . 71.140000000000001 110.945 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.41 -76.17 0.06 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.124 -0.489 . . . . 55.140000000000001 111.084 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -39.69 -39.49 0.77 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.433 . . . . 75.239999999999995 110.866 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.9 m -61.01 -76.31 0.05 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 74.310000000000002 110.89 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.607 ' HB3' ' HB2' ' A' ' 107' ' ' ALA . 29.0 mtt85 -50.04 -45.61 52.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 64.230000000000004 110.855 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.434 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.9 m-85 -57.6 -37.22 72.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 64.349999999999994 110.941 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -62.75 -16.92 59.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 74.530000000000001 110.86 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.94 -20.54 12.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.238 -0.437 . . . . 61.219999999999999 110.926 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.8 28.75 11.65 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.724 -0.75 . . . . 73.049999999999997 112.458 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -106.71 -8.55 16.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.846 0.355 . . . . 71.230000000000004 110.905 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.607 ' HB2' ' HB3' ' A' ' 101' ' ' ARG . . . -115.06 13.65 16.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 22.02 111.088 179.888 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.467 ' HB2' HD11 ' A' ' 114' ' ' ILE . 1.9 pt20 -126.48 55.72 14.75 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.618 0.723 . . . . 71.140000000000001 110.863 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.502 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.5 Cg_endo -69.78 36.54 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.661 2.241 . . . . 64.450000000000003 112.358 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' HIS . . . . . 0.753 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 1.0 OUTLIER 72.05 33.92 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.551 0.691 . . . . 74.340000000000003 110.828 179.917 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 111' ' ' PRO . . . . . 0.753 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.2 Cg_endo -69.7 -164.14 0.12 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.722 2.281 . . . . 74.129999999999995 112.364 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.35 -32.81 32.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 63.140000000000001 110.861 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.547 HG23 ' HB3' ' A' ' 92' ' ' PHE . 22.7 m -52.7 -54.09 38.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.158 -0.474 . . . . 73.420000000000002 111.18 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.467 HD11 ' HB2' ' A' ' 108' ' ' GLN . 46.4 mm -50.95 -45.24 28.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 62.530000000000001 111.165 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.484 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -63.75 -29.51 70.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 73.219999999999999 110.89 179.867 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.484 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.3 mp -80.01 -49.86 11.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.199 -0.455 . . . . 74.040000000000006 110.917 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.775 HD13 HG22 ' A' ' 74' ' ' ILE . 20.6 mt -55.42 -47.97 75.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 65.230000000000004 110.91 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.682 ' HG3' HG13 ' A' ' 119' ' ' VAL . 17.3 ptp180 -55.18 -35.54 64.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 60.539999999999999 110.908 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.682 HG13 ' HG3' ' A' ' 118' ' ' ARG . 18.8 m -96.95 0.32 10.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 73.219999999999999 111.132 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.736 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.7 OUTLIER -93.1 -36.52 12.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 72.209999999999994 110.878 179.95 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -53.03 -24.37 9.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.12 -0.491 . . . . 72.409999999999997 110.882 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.481 ' HD3' ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -99.7 -20.2 16.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 73.219999999999999 110.935 179.982 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.736 ' O ' HD13 ' A' ' 120' ' ' LEU . 52.3 m80 -132.52 93.4 25.02 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.604 0.716 . . . . 61.530000000000001 110.934 179.815 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.605 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.7 Cg_endo -69.77 -0.02 6.32 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.7 2.267 . . . . 63.340000000000003 112.333 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -114.31 -11.34 12.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.259 -0.428 . . . . 74.540000000000006 110.902 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.682 ' O ' HG23 ' A' ' 130' ' ' ILE . 7.8 tp -53.27 -49.15 67.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.122 -0.49 . . . . 71.219999999999999 110.861 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.743 HD13 HD11 ' A' ' 83' ' ' LEU . 2.0 pt? -51.28 -28.86 13.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.276 -0.42 . . . . 64.0 110.863 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.487 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.36 -27.11 24.46 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.216 -0.447 . . . . 73.409999999999997 110.844 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.402 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.1 pp20? -94.12 2.46 55.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.269 -0.423 . . . . 71.439999999999998 110.899 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.682 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.3 pt -121.47 -34.26 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 75.140000000000001 111.176 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.77 ' HB3' HD12 ' A' ' 91' ' ' ILE . 2.5 ptt-85 . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.104 -0.498 . . . . 65.420000000000002 110.826 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mtt . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.867 0.365 . . . . 71.030000000000001 110.88 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.34 -170.58 0.53 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 75.439999999999998 110.846 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.435 ' O ' ' N ' ' A' ' 7' ' ' HIS . 0.1 OUTLIER 174.27 59.1 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.596 0.713 . . . . 43.340000000000003 110.847 179.922 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -2.64 10.54 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.689 2.259 . . . . 71.420000000000002 112.328 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.466 HG23 ' N ' ' A' ' 6' ' ' CYS . 30.5 m -84.08 -43.14 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.255 -0.429 . . . . 73.209999999999994 111.106 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.466 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.8 OUTLIER -125.77 -28.62 3.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 61.32 110.888 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.435 ' N ' ' O ' ' A' ' 3' ' ' CYS . 19.0 m80 67.66 46.31 1.35 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 72.329999999999998 110.878 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -107.6 -74.05 0.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.434 . . . . 75.219999999999999 110.872 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.81 -134.72 8.55 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.719 -0.753 . . . . 52.109999999999999 112.483 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.477 ' O ' HG12 ' A' ' 12' ' ' VAL . 5.9 pt-20 -155.19 88.26 1.16 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 70.420000000000002 110.863 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.551 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -48.97 105.5 0.08 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 75.519999999999996 110.895 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.477 HG12 ' O ' ' A' ' 10' ' ' GLU . 3.9 p -142.01 126.65 16.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 64.129999999999995 111.145 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.586 ' N ' HD23 ' A' ' 35' ' ' LEU . 2.4 p -49.09 130.98 19.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 73.310000000000002 110.865 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.411 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 178.94 80.76 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.748 -0.739 . . . . 74.040000000000006 112.464 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.415 HD12 ' N ' ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.12 146.83 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.93 0.395 . . . . 74.439999999999998 111.108 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.8 -165.51 1.66 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.124 -0.489 . . . . 73.340000000000003 110.893 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.679 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -95.59 116.97 29.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.235 -0.439 . . . . 75.120000000000005 110.907 179.861 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.713 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.2 mm -107.59 91.96 7.93 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.652 0.739 . . . . 71.030000000000001 111.142 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.431 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.9 Cg_endo -69.76 96.89 0.61 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.654 2.236 . . . . 61.100000000000001 112.344 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.425 ' HB3' HG23 ' A' ' 27' ' ' THR . 15.0 t80 -64.5 -36.92 85.74 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 63.409999999999997 110.919 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.491 HG21 ' HG2' ' A' ' 25' ' ' ARG . 16.7 m -128.87 146.79 50.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 61.119999999999997 111.139 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.8 p90 -143.87 36.18 1.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 73.400000000000006 110.882 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.55 -40.23 2.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 71.450000000000003 110.854 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -157.42 -57.92 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.713 -0.756 . . . . 64.209999999999994 112.478 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.491 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -91.18 46.31 1.3 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.876 0.37 . . . . 74.319999999999993 110.882 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.414 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 14.4 tttm -53.09 116.48 2.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 73.319999999999993 110.887 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.425 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -130.74 92.55 3.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 73.420000000000002 111.123 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.679 HG11 ' HB2' ' A' ' 17' ' ' ASP . 44.5 t -77.07 127.55 38.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 73.310000000000002 111.073 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.742 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -85.05 51.43 2.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 62.310000000000002 110.893 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 29' ' ' LEU . 19.0 mttm -38.08 107.69 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 71.219999999999999 110.933 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 119.45 46.58 0.4 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.764 -0.732 . . . . 72.209999999999994 112.534 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.576 HD11 ' HB3' ' A' ' 29' ' ' LEU . 15.1 mm -107.73 91.69 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.884 0.373 . . . . 61.5 111.117 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.27 154.61 38.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 61.350000000000001 110.883 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 168.32 -109.33 0.33 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.761 -0.733 . . . . 52.539999999999999 112.502 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.74 HD12 ' HB ' ' A' ' 44' ' ' ILE . 53.8 mt -156.98 87.0 0.98 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.856 0.36 . . . . 71.400000000000006 110.897 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -159.73 160.18 33.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 74.140000000000001 110.921 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.7 t -171.82 -40.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.137 -0.483 . . . . 73.400000000000006 110.905 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 39' ' ' HIS . 2.6 p -120.9 -46.54 2.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 53.439999999999998 111.139 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.407 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -92.1 170.65 9.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.494 . . . . 71.530000000000001 110.807 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.47 21.12 2.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.196 -0.456 . . . . 74.129999999999995 110.877 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -112.0 -61.79 1.66 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 54.200000000000003 110.863 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.526 ' HG3' ' HE3' ' A' ' 11' ' ' MET . 11.5 tp10 -77.34 61.67 2.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 65.019999999999996 110.874 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.0 p -95.24 154.28 17.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 74.120000000000005 110.859 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.74 ' HB ' HD12 ' A' ' 35' ' ' LEU . 19.0 mm -140.89 139.84 33.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 74.120000000000005 111.136 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.6 mtt -142.15 143.84 33.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 73.230000000000004 110.909 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.1 m-20 -92.51 -169.67 2.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.236 -0.438 . . . . 64.129999999999995 110.893 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -60.92 2.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 53.329999999999998 110.902 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.91 -57.58 8.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.262 -0.427 . . . . 74.319999999999993 110.857 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.72 -58.01 6.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 70.329999999999998 110.865 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.8 t -53.65 -42.64 68.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 71.310000000000002 110.809 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.2 -44.14 83.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.164 -0.471 . . . . 72.140000000000001 110.856 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.14 -62.08 1.75 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 63.450000000000003 111.093 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.463 ' O ' HG13 ' A' ' 57' ' ' VAL . 20.8 t80 -52.05 -46.21 65.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 75.510000000000005 110.834 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.42 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.94 -51.33 64.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 72.25 110.905 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -50.51 -40.24 50.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.444 . . . . 62.539999999999999 111.099 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.742 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -72.07 -67.85 0.51 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 50.130000000000003 110.902 -179.928 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.463 HG13 ' O ' ' A' ' 53' ' ' PHE . 15.2 m -46.47 -36.87 3.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.448 . . . . 74.129999999999995 111.135 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.62 -50.73 33.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 73.219999999999999 110.908 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.11 -50.99 60.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 72.219999999999999 111.066 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.637 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -66.53 -46.16 77.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 72.140000000000001 110.874 -179.888 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.48 -51.51 35.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.133 -0.485 . . . . 72.019999999999996 110.872 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.37 -54.68 25.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 75.129999999999995 111.095 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.08 -40.53 32.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.243 -0.435 . . . . 54.299999999999997 110.86 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.637 HG23 ' O ' ' A' ' 60' ' ' PHE . 42.4 t -79.68 -27.4 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.132 -0.485 . . . . 72.400000000000006 111.15 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.93 -19.41 60.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 74.219999999999999 110.905 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.74 -22.07 63.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 75.049999999999997 111.099 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -60.09 -175.27 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 75.409999999999997 110.931 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . 1.029 HG22 HG13 ' A' ' 69' ' ' VAL . 86.4 m -57.36 -77.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.172 -0.467 . . . . 74.540000000000006 111.125 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 1.029 HG13 HG22 ' A' ' 68' ' ' THR . 4.6 m -139.35 -175.7 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 73.319999999999993 111.1 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.535 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.02 159.41 29.74 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.587 0.708 . . . . 43.119999999999997 111.079 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.683 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.3 Cg_endo -69.8 -7.54 21.34 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.682 2.255 . . . . 72.519999999999996 112.292 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -92.19 -39.5 11.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 71.530000000000001 110.876 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -57.34 -61.17 2.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 71.329999999999998 110.88 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.683 HD11 ' HA ' ' A' ' 71' ' ' PRO . 0.3 OUTLIER -44.74 -68.11 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 74.209999999999994 111.136 179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.1 m -48.85 -39.09 11.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 71.120000000000005 111.144 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.6 mtmt -60.4 -39.41 87.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 74.409999999999997 110.9 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.458 ' HB ' HD22 ' A' ' 117' ' ' LEU . 99.6 t -70.35 -37.97 72.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 74.5 111.167 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.66 -33.33 72.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 54.240000000000002 110.859 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.1 pttt -89.53 -19.25 25.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 74.109999999999999 110.886 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 21.8 ttmt -75.97 -51.19 12.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 71.230000000000004 110.87 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.851 HD13 HD12 ' A' ' 120' ' ' LEU . 8.3 mt -92.09 14.66 15.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.205 -0.452 . . . . 64.349999999999994 110.915 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.32 41.13 27.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 54.039999999999999 110.881 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.842 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.5 mm? -79.04 86.46 4.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.138 -0.483 . . . . 70.209999999999994 110.872 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.668 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -45.83 156.05 0.15 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 63.520000000000003 111.157 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.23 -19.41 54.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 75.239999999999995 110.883 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -53.21 6.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 73.010000000000005 110.917 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.668 ' H ' HG23 ' A' ' 84' ' ' THR . 1.2 tt0 -62.63 -49.34 75.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.234 -0.439 . . . . 64.099999999999994 110.946 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.443 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -55.57 -31.64 62.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 73.150000000000006 111.153 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 24.5 p -80.02 -35.79 36.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 62.399999999999999 110.885 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -74.81 -22.82 58.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.09 -0.504 . . . . 63.229999999999997 110.904 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.704 ' CD1' HD12 ' A' ' 127' ' ' LEU . 52.8 mt -103.71 -62.87 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 61.130000000000003 111.142 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.552 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.8 m-85 -75.64 -63.95 1.18 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 75.430000000000007 110.902 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 124.69 34.36 0.7 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.731 -0.747 . . . . 44.310000000000002 112.475 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -52.01 -50.14 46.2 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.743 -0.741 . . . . 41.520000000000003 112.51 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.95 -137.11 13.88 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.739 -0.743 . . . . 71.530000000000001 112.526 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.14 -73.36 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.781 0.324 . . . . 62.219999999999999 111.147 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -85.25 40.94 0.85 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 71.140000000000001 110.89 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -60.35 -75.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 55.140000000000001 111.053 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.417 ' C ' ' O ' ' A' ' 98' ' ' ALA . 25.4 m-85 -36.38 -47.03 0.58 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 75.239999999999995 110.849 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.1 m -57.38 -76.08 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.481 . . . . 74.310000000000002 110.899 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.531 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 8.0 mtt180 -47.39 -52.8 15.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.08 -0.509 . . . . 64.230000000000004 110.859 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.568 ' HB3' HD12 ' A' ' 74' ' ' ILE . 10.6 m-85 -49.67 -38.26 31.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 64.349999999999994 110.923 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -54.33 -38.85 66.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.13 -0.486 . . . . 74.530000000000001 110.894 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.22 -17.32 22.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.139 -0.482 . . . . 61.219999999999999 110.916 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.28 26.19 16.7 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.751 -0.738 . . . . 73.049999999999997 112.47 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 74.7 m-80 -94.3 -24.65 17.34 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.863 0.363 . . . . 71.230000000000004 110.925 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.531 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -105.05 18.7 21.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 22.02 111.085 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.495 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.1 OUTLIER -120.39 55.98 4.39 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.637 0.732 . . . . 71.140000000000001 110.941 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.4 Cg_endo -69.77 28.67 0.18 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.664 2.243 . . . . 64.450000000000003 112.334 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.694 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.9 OUTLIER 69.42 38.37 0.17 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.547 0.689 . . . . 74.340000000000003 110.842 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.694 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.5 Cg_endo -69.7 -165.49 0.15 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.689 2.259 . . . . 74.129999999999995 112.369 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 14.1 m -81.46 -34.41 31.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 63.140000000000001 110.845 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.552 HG23 ' HB3' ' A' ' 92' ' ' PHE . 14.8 m -48.78 -42.34 35.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 73.420000000000002 111.192 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.421 HD11 ' HG2' ' A' ' 108' ' ' GLN . 27.7 mm -60.26 -44.0 94.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 62.530000000000001 111.133 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.658 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -64.18 -29.34 70.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.169 -0.469 . . . . 73.219999999999999 110.864 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.658 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.6 mp -81.24 -42.83 20.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.244 -0.435 . . . . 74.040000000000006 110.881 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.638 HD13 HG22 ' A' ' 74' ' ' ILE . 36.1 mt -61.09 -49.45 77.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 65.230000000000004 110.925 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.561 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.7 ptp180 -51.92 -39.76 59.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 60.539999999999999 110.914 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.561 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.8 m -88.13 -13.01 10.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 73.219999999999999 111.092 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.851 HD12 HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -79.06 -41.35 29.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 72.209999999999994 110.874 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -48.79 -32.82 9.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 72.409999999999997 110.876 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.2 -21.39 17.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 73.219999999999999 110.941 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.74 ' O ' HD13 ' A' ' 120' ' ' LEU . 42.1 m-70 -126.52 87.66 55.94 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.552 0.691 . . . . 61.530000000000001 110.863 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.658 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.5 Cg_endo -69.71 3.37 2.78 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.692 2.261 . . . . 63.340000000000003 112.392 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -117.22 -12.45 10.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.177 -0.465 . . . . 74.540000000000006 110.898 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.663 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.2 tp -54.06 -46.57 72.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.168 -0.469 . . . . 71.219999999999999 110.932 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.704 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.73 -29.42 7.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 64.0 110.891 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.506 HD21 HH12 ' A' ' 131' ' ' ARG . 6.4 m120 -86.59 -27.55 23.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 73.409999999999997 110.885 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.43 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -94.68 5.03 53.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 71.439999999999998 110.859 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 126' ' ' LEU . 11.6 pt -124.29 -35.12 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.471 . . . . 75.140000000000001 111.117 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.506 HH12 HD21 ' A' ' 128' ' ' ASN . 1.2 ptt-85 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.178 -0.465 . . . . 65.420000000000002 110.893 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.51 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.895 0.379 . . . . 71.030000000000001 110.917 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.83 -169.04 0.39 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 75.439999999999998 110.893 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.8 p 176.73 59.86 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.382 0 CA-C-O 121.576 0.703 . . . . 43.340000000000003 110.883 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.84 4.8 2.02 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.646 2.231 . . . . 71.420000000000002 112.297 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.2 m -104.01 -45.79 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.436 . . . . 73.209999999999994 111.141 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.4 m -107.77 -34.15 7.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 61.32 110.885 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 61.03 46.45 8.3 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.089 -0.505 . . . . 72.329999999999998 110.896 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -109.35 -74.21 0.66 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.166 -0.47 . . . . 75.219999999999999 110.943 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.541 ' HA3' HG23 ' A' ' 38' ' ' VAL . . . -107.95 -106.9 3.12 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.695 -0.764 . . . . 52.109999999999999 112.535 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.51 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 5.5 pt-20 -176.56 96.37 0.05 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.89 0.376 . . . . 70.420000000000002 110.889 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.595 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.8 ptp -52.58 104.76 0.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.168 -0.469 . . . . 75.519999999999996 110.92 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.497 HG12 ' O ' ' A' ' 10' ' ' GLU . 4.2 p -143.02 126.1 13.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.254 -0.43 . . . . 64.129999999999995 111.151 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.595 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -49.77 128.37 17.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.124 -0.489 . . . . 73.310000000000002 110.861 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.416 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.26 84.28 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.778 -0.725 . . . . 74.040000000000006 112.532 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.416 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.67 145.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.872 0.368 . . . . 74.439999999999998 111.146 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.53 -167.28 2.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 73.340000000000003 110.856 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.692 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -93.44 118.15 30.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 75.120000000000005 110.86 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.736 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.3 mm -109.28 91.17 9.28 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.667 0.746 . . . . 71.030000000000001 111.161 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.473 ' HA ' HG22 ' A' ' 28' ' ' VAL . 54.3 Cg_endo -69.67 95.81 0.56 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.745 2.297 . . . . 61.100000000000001 112.404 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -63.43 -37.27 86.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 63.409999999999997 110.901 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.485 HG21 ' HG2' ' A' ' 25' ' ' ARG . 19.2 m -131.21 149.67 52.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.091 -0.504 . . . . 61.119999999999997 111.205 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -148.51 44.22 1.02 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.27 -0.423 . . . . 73.400000000000006 110.926 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.29 -46.14 0.77 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.117 -0.492 . . . . 71.450000000000003 110.84 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -149.08 -50.46 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.67 -0.776 . . . . 64.209999999999994 112.469 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.485 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -101.7 47.1 0.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.912 0.387 . . . . 74.319999999999993 110.876 -179.827 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.428 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 14.8 tttt -55.33 121.62 9.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 73.319999999999993 110.9 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.416 HG23 ' O ' ' A' ' 27' ' ' THR . 1.8 t -138.52 93.83 2.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 73.420000000000002 111.134 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.692 HG11 ' HB2' ' A' ' 17' ' ' ASP . 44.2 t -77.55 128.14 38.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 73.310000000000002 111.104 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.745 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.2 OUTLIER -84.51 51.92 2.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 62.310000000000002 110.955 179.906 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 29' ' ' LEU . 29.0 mttp -37.4 107.7 0.07 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 71.219999999999999 110.859 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.27 50.05 0.39 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.713 -0.756 . . . . 72.209999999999994 112.478 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.6 HD11 ' HB3' ' A' ' 29' ' ' LEU . 19.0 mm -109.36 93.04 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.787 0.327 . . . . 61.5 111.166 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.27 150.7 38.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 61.350000000000001 110.822 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.9 -106.12 0.25 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.805 -0.712 . . . . 52.539999999999999 112.501 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.774 HD12 ' HB ' ' A' ' 44' ' ' ILE . 43.5 mt -156.65 84.82 0.97 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.875 0.369 . . . . 71.400000000000006 110.873 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.497 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -158.74 162.51 37.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 74.140000000000001 110.916 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.2 t -171.28 -37.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.094 -0.503 . . . . 73.400000000000006 110.904 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.541 HG23 ' HA3' ' A' ' 9' ' ' GLY . 0.3 OUTLIER -128.13 -40.56 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 53.439999999999998 111.141 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -97.05 170.89 8.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.129 -0.487 . . . . 71.530000000000001 110.835 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.25 12.96 2.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.216 -0.447 . . . . 74.129999999999995 110.866 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -103.07 -65.2 1.01 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 54.200000000000003 110.872 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -76.98 61.46 1.97 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.193 -0.458 . . . . 65.019999999999996 110.886 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.5 m -102.06 160.6 14.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 74.120000000000005 110.814 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.774 ' HB ' HD12 ' A' ' 35' ' ' LEU . 15.3 mm -141.14 140.79 31.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.118 -0.492 . . . . 74.120000000000005 111.135 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 16.2 mtm -143.8 132.45 22.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.087 -0.506 . . . . 73.230000000000004 110.889 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 35.8 m-20 -82.65 -169.72 2.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 64.129999999999995 110.871 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -61.44 2.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 53.329999999999998 110.87 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -51.63 -57.47 9.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.406 . . . . 74.319999999999993 110.872 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -50.54 -57.08 8.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 70.329999999999998 110.94 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.0 t -55.08 -40.06 69.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.495 . . . . 71.310000000000002 110.871 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.44 -45.62 88.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.129 -0.487 . . . . 72.140000000000001 110.877 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.22 -59.98 3.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 63.450000000000003 111.096 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.432 ' O ' HG13 ' A' ' 57' ' ' VAL . 14.8 t80 -53.32 -48.51 68.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.267 -0.424 . . . . 75.510000000000005 110.832 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.423 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.28 -48.48 79.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 72.25 110.886 179.956 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.2 -41.51 62.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 62.539999999999999 111.137 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.745 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -70.28 -66.67 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 50.130000000000003 110.854 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.458 HG12 HD21 ' A' ' 29' ' ' LEU . 12.0 m -47.5 -35.79 4.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.275 -0.42 . . . . 74.129999999999995 111.148 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -69.43 -54.48 14.17 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.188 -0.46 . . . . 73.219999999999999 110.858 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.16 -52.25 27.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 72.219999999999999 111.116 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.629 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -63.32 -48.61 77.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.204 -0.453 . . . . 72.140000000000001 110.88 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.8 -36.49 37.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 72.019999999999996 110.856 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.58 -53.75 9.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.462 . . . . 75.129999999999995 111.116 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.34 -25.73 64.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 54.299999999999997 110.84 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.629 HG22 ' O ' ' A' ' 60' ' ' PHE . 16.3 m -97.48 -16.24 7.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.467 . . . . 72.400000000000006 111.092 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.79 -22.95 27.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.23 -0.441 . . . . 74.219999999999999 110.899 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -50.81 -30.22 13.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 75.049999999999997 111.143 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -113.15 139.65 48.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.278 -0.419 . . . . 75.409999999999997 110.883 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . 1.016 HG22 HG13 ' A' ' 69' ' ' VAL . 97.3 m -66.04 -75.39 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.145 -0.479 . . . . 74.540000000000006 111.155 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 1.016 HG13 HG22 ' A' ' 68' ' ' THR . 10.8 m -131.95 -172.22 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.252 -0.431 . . . . 73.319999999999993 111.169 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.537 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -105.24 159.44 29.4 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.559 0.695 . . . . 43.119999999999997 111.105 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.644 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.2 Cg_endo -69.79 -7.37 20.9 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.686 2.258 . . . . 72.519999999999996 112.369 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -92.26 -38.72 11.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.434 . . . . 71.530000000000001 110.832 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -57.58 -61.36 2.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 71.329999999999998 110.898 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.804 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -45.15 -67.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 74.209999999999994 111.183 179.933 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.8 m -48.88 -39.33 11.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 71.120000000000005 111.098 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 23.1 mtmt -61.14 -45.04 96.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 74.409999999999997 110.864 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.596 HG22 ' HB2' ' A' ' 121' ' ' ASP . 75.8 t -61.81 -39.05 82.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.234 -0.439 . . . . 74.5 111.118 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.451 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -64.37 -58.71 5.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 54.240000000000002 110.924 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -24.91 67.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 74.109999999999999 110.937 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 18.5 ttmt -68.23 -52.02 38.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.184 -0.462 . . . . 71.230000000000004 110.898 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.847 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.5 mt -91.82 12.53 21.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 64.349999999999994 110.898 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.1 t 53.74 37.48 26.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 54.039999999999999 110.898 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.847 HD23 ' HB2' ' A' ' 81' ' ' LEU . 2.0 mm? -79.69 87.31 5.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 70.209999999999994 110.922 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.644 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.73 156.38 0.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 63.520000000000003 111.129 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.14 -21.15 58.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 75.239999999999995 110.899 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -50.13 10.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.254 -0.43 . . . . 73.010000000000005 110.873 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.644 ' H ' HG23 ' A' ' 84' ' ' THR . 0.9 OUTLIER -64.95 -53.0 53.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 64.099999999999994 110.84 179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -52.19 -33.66 41.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.135 -0.484 . . . . 73.150000000000006 111.072 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 23.1 t -79.56 -36.61 38.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 62.399999999999999 110.837 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -72.95 -24.38 60.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.112 -0.495 . . . . 63.229999999999997 110.939 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.713 ' CD1' HD12 ' A' ' 127' ' ' LEU . 51.4 mt -101.81 -63.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 61.130000000000003 111.095 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.582 ' HB3' HG23 ' A' ' 113' ' ' THR . 8.3 m-85 -74.34 -60.68 2.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 75.430000000000007 110.826 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 110.26 49.37 0.72 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.701 -0.762 . . . . 44.310000000000002 112.438 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.88 -36.91 31.03 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.764 -0.731 . . . . 41.520000000000003 112.501 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.412 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 102.82 165.08 26.03 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.771 -0.728 . . . . 71.530000000000001 112.522 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.49 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.8 p -50.93 -50.89 22.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.89 0.376 . . . . 62.219999999999999 111.12 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.49 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.7 OUTLIER -86.87 38.46 0.8 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.487 . . . . 71.140000000000001 110.89 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.412 ' HB2' ' O ' ' A' ' 95' ' ' GLY . . . -63.85 -76.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 55.140000000000001 111.097 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -43.02 -40.37 3.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 75.239999999999995 110.877 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.1 m -59.98 -75.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.145 -0.479 . . . . 74.310000000000002 110.857 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.63 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 32.5 mtt180 -50.03 -45.72 52.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.094 -0.503 . . . . 64.230000000000004 110.873 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.72 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.0 m-85 -55.41 -37.31 67.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.24 -0.436 . . . . 64.349999999999994 110.852 -179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -51.3 -30.11 17.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 74.530000000000001 110.928 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -106.96 -22.11 12.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.478 . . . . 61.219999999999999 110.889 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.69 26.75 9.57 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.784 -0.722 . . . . 73.049999999999997 112.539 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -98.06 -4.7 35.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.822 0.344 . . . . 71.230000000000004 110.83 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.63 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -112.11 8.7 20.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 22.02 111.041 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.558 ' HB2' HD11 ' A' ' 114' ' ' ILE . 2.0 pt20 -124.73 57.44 15.09 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.563 0.697 . . . . 71.140000000000001 110.855 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.53 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.9 Cg_endo -69.78 36.32 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.646 2.231 . . . . 64.450000000000003 112.342 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.772 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.5 t-160 73.93 32.28 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.522 0.677 . . . . 74.340000000000003 110.846 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.772 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 52.8 Cg_endo -69.86 -163.84 0.12 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.638 2.225 . . . . 74.129999999999995 112.316 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.44 -30.26 23.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.251 -0.432 . . . . 63.140000000000001 110.845 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.582 HG23 ' HB3' ' A' ' 92' ' ' PHE . 21.1 m -53.34 -50.57 64.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.138 -0.483 . . . . 73.420000000000002 111.141 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.558 HD11 ' HB2' ' A' ' 108' ' ' GLN . 41.0 mm -51.31 -42.36 26.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 62.530000000000001 111.136 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.555 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -68.17 -29.63 68.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.166 -0.47 . . . . 73.219999999999999 110.914 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.555 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.7 mp -79.25 -42.1 26.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 74.040000000000006 110.941 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.804 HD13 HG22 ' A' ' 74' ' ' ILE . 17.0 mt -63.93 -48.93 74.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 65.230000000000004 110.909 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.597 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.9 ptp180 -52.2 -34.81 47.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 60.539999999999999 110.882 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.597 HG13 ' HG3' ' A' ' 118' ' ' ARG . 30.9 m -93.88 -13.91 8.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.475 . . . . 73.219999999999999 111.144 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.82 HD12 HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -77.14 -40.29 46.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 72.209999999999994 110.9 179.954 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.596 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.5 OUTLIER -50.0 -31.23 12.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.187 -0.461 . . . . 72.409999999999997 110.822 179.88 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.35 -20.86 18.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 73.219999999999999 110.868 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.741 ' O ' HD13 ' A' ' 120' ' ' LEU . 53.7 m-70 -128.55 88.59 51.87 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.565 0.698 . . . . 61.530000000000001 110.835 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.704 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.9 Cg_endo -69.71 3.4 2.76 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.646 2.231 . . . . 63.340000000000003 112.367 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -117.83 -11.98 10.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.43 . . . . 74.540000000000006 110.912 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.527 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.5 tp -53.54 -47.99 69.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.199 -0.455 . . . . 71.219999999999999 110.976 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.713 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.9 pt? -46.32 -32.77 3.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.467 . . . . 64.0 110.871 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -81.87 -38.1 25.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.17 -0.468 . . . . 73.409999999999997 110.907 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.578 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -78.74 -6.18 55.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.458 . . . . 71.439999999999998 110.89 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.578 HG23 ' HG3' ' A' ' 129' ' ' GLU . 7.9 pt -119.17 -20.41 4.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 75.140000000000001 111.119 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.427 ' HG2' HG23 ' A' ' 91' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 65.420000000000002 110.892 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mtt . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.885 0.374 . . . . 71.030000000000001 110.88 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.02 -169.43 0.4 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 75.439999999999998 110.947 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.7 t -178.91 60.12 0.12 Allowed Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.588 0.709 . . . . 43.340000000000003 110.876 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -0.1 6.46 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 122.715 2.277 . . . . 71.420000000000002 112.324 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.628 HG21 ' OE1' ' A' ' 42' ' ' GLU . 27.8 m -87.52 -43.96 15.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.268 -0.424 . . . . 73.209999999999994 111.153 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.457 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -127.17 -30.8 2.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.474 . . . . 61.32 110.913 179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 22.1 m-70 69.79 68.91 0.23 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 72.329999999999998 110.897 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.414 ' NE2' ' HB3' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -132.52 -71.72 0.53 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 75.219999999999999 110.994 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.34 -129.99 6.84 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.71 -0.757 . . . . 52.109999999999999 112.482 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.459 ' O ' HG12 ' A' ' 12' ' ' VAL . 9.6 pt-20 -161.2 87.89 0.73 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.799 0.333 . . . . 70.420000000000002 110.88 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.561 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -50.64 105.04 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.146 -0.479 . . . . 75.519999999999996 110.874 179.951 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 10' ' ' GLU . 5.0 p -142.58 126.93 15.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 64.129999999999995 111.132 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.589 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.4 OUTLIER -49.51 129.28 18.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 73.310000000000002 110.791 -179.815 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.406 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 179.98 81.46 0.06 OUTLIER Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.72 -0.753 . . . . 74.040000000000006 112.46 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.414 HD12 ' N ' ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.02 146.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.912 0.386 . . . . 74.439999999999998 111.088 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.91 -165.4 1.62 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.12 -0.491 . . . . 73.340000000000003 110.854 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.654 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.6 OUTLIER -95.48 117.15 29.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 75.120000000000005 110.792 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.734 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.0 mm -107.88 91.53 7.77 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.623 0.725 . . . . 71.030000000000001 111.203 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.408 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.7 Cg_endo -69.72 96.48 0.59 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.678 2.252 . . . . 61.100000000000001 112.343 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.514 ' HB3' HG23 ' A' ' 27' ' ' THR . 16.6 t80 -61.15 -40.04 92.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 63.409999999999997 110.944 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.479 HG21 ' HG2' ' A' ' 25' ' ' ARG . 15.7 m -126.72 145.18 50.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.126 -0.488 . . . . 61.119999999999997 111.17 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -134.02 45.54 2.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 73.400000000000006 110.857 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.45 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -132.09 -68.4 0.63 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 71.450000000000003 110.911 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -136.08 -46.35 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.704 -0.76 . . . . 64.209999999999994 112.475 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.479 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.38 39.84 1.09 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.912 0.387 . . . . 74.319999999999993 110.918 -179.853 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -52.67 115.23 1.7 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.079 -0.51 . . . . 73.319999999999993 110.907 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.514 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -127.76 93.81 3.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 73.420000000000002 111.118 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.654 HG11 ' HB2' ' A' ' 17' ' ' ASP . 43.7 t -77.69 126.42 38.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 73.310000000000002 111.133 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.74 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.61 51.42 2.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 62.310000000000002 110.923 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.402 ' C ' ' O ' ' A' ' 29' ' ' LEU . 23.1 mttp -38.06 108.03 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 71.219999999999999 110.866 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.86 46.66 0.42 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.681 -0.771 . . . . 72.209999999999994 112.46 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.576 HD11 ' HB3' ' A' ' 29' ' ' LEU . 14.9 mm -107.61 91.22 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.838 0.352 . . . . 61.5 111.104 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.01 154.29 39.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.209 -0.451 . . . . 61.350000000000001 110.827 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.99 -108.57 0.31 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.709 -0.757 . . . . 52.539999999999999 112.491 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.757 HD12 ' HB ' ' A' ' 44' ' ' ILE . 49.9 mt -157.11 86.12 0.96 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.847 0.356 . . . . 71.400000000000006 110.874 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.402 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.02 161.08 33.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.151 -0.477 . . . . 74.140000000000001 110.905 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.6 t -169.58 -38.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.109 -0.496 . . . . 73.400000000000006 110.853 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.6 m -125.79 -47.18 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 53.439999999999998 111.153 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.88 170.43 10.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 71.530000000000001 110.892 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.9 t -137.4 15.91 2.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 74.129999999999995 110.863 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -104.82 -62.99 1.26 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 54.200000000000003 110.876 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.628 ' OE1' HG21 ' A' ' 5' ' ' VAL . 7.8 tp10 -77.15 61.93 2.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 65.019999999999996 110.897 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.6 p -97.09 154.21 17.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.088 -0.505 . . . . 74.120000000000005 110.891 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.757 ' HB ' HD12 ' A' ' 35' ' ' LEU . 20.1 mm -141.25 139.77 32.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 74.120000000000005 111.158 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.8 mtt -142.88 139.68 30.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.425 . . . . 73.230000000000004 110.852 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 41.1 m-20 -87.59 -169.94 2.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 64.129999999999995 110.885 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -61.03 2.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.191 -0.459 . . . . 53.329999999999998 110.843 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.48 -57.44 9.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 74.319999999999993 110.979 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.02 -58.15 6.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.031 -0.531 . . . . 70.329999999999998 110.84 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.5 t -53.49 -42.38 67.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 71.310000000000002 110.926 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.59 -44.0 85.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.093 -0.503 . . . . 72.140000000000001 110.936 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.77 -61.82 1.95 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 63.450000000000003 111.106 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.501 ' O ' HG13 ' A' ' 57' ' ' VAL . 18.1 t80 -52.6 -46.7 67.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.455 . . . . 75.510000000000005 110.859 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.44 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.41 -49.03 75.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.499 . . . . 72.25 110.91 179.98 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.94 -42.66 63.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.474 . . . . 62.539999999999999 111.135 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.74 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -69.65 -66.54 0.57 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 50.130000000000003 110.884 -179.944 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.501 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.3 m -47.24 -35.72 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 74.129999999999995 111.143 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.7 mmmt -69.07 -54.89 12.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 73.219999999999999 110.883 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.07 -53.58 19.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.246 -0.434 . . . . 72.219999999999999 111.063 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.701 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -62.88 -49.27 75.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.45 . . . . 72.140000000000001 110.868 -179.889 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.74 -36.31 25.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 72.019999999999996 110.823 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.65 -54.04 9.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.265 -0.425 . . . . 75.129999999999995 111.158 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.21 -28.27 64.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 54.299999999999997 110.884 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.701 HG22 ' O ' ' A' ' 60' ' ' PHE . 23.2 m -94.9 -17.29 7.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.095 -0.502 . . . . 72.400000000000006 111.166 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.67 -30.3 55.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 74.219999999999999 110.862 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.75 -18.9 57.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 75.049999999999997 111.106 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -67.07 -18.42 65.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.45 . . . . 75.409999999999997 110.893 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.924 HG22 HG13 ' A' ' 69' ' ' VAL . 62.2 m -49.1 -69.23 0.12 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 74.540000000000006 111.089 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.924 HG13 HG22 ' A' ' 68' ' ' THR . 7.1 m -138.48 -173.12 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 73.319999999999993 111.144 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.546 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.8 159.95 28.06 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.617 0.722 . . . . 43.119999999999997 111.104 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.574 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.4 Cg_endo -69.86 -7.48 21.2 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.658 2.239 . . . . 72.519999999999996 112.312 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -93.92 -37.44 11.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 71.530000000000001 110.856 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -57.76 -61.58 2.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.188 -0.46 . . . . 71.329999999999998 110.896 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.792 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.92 -67.33 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.154 -0.476 . . . . 74.209999999999994 111.106 -179.984 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -48.88 -39.49 11.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 71.120000000000005 111.09 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 22.5 mtmt -60.6 -46.17 91.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.459 . . . . 74.409999999999997 110.873 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.611 HG22 ' HB2' ' A' ' 121' ' ' ASP . 73.4 t -60.92 -39.3 81.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 74.5 111.094 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.441 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -63.91 -60.73 2.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.181 -0.463 . . . . 54.240000000000002 110.848 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -22.91 66.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 74.109999999999999 110.832 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -68.94 -54.04 17.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 71.230000000000004 110.884 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.701 HD22 ' HB3' ' A' ' 124' ' ' PRO . 9.2 mt -91.52 14.69 14.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.24 -0.436 . . . . 64.349999999999994 110.909 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 11.0 m 53.19 39.47 29.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 54.039999999999999 110.838 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.694 HD22 ' CE2' ' A' ' 92' ' ' PHE . 0.4 OUTLIER -79.69 88.17 5.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 70.209999999999994 110.958 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.676 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -46.73 156.87 0.17 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 63.520000000000003 111.197 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -59.67 -19.79 51.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 75.239999999999995 110.916 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 33.2 mmtt -82.45 -52.45 6.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.194 -0.457 . . . . 73.010000000000005 110.873 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.676 ' H ' HG23 ' A' ' 84' ' ' THR . 2.8 tt0 -61.75 -51.78 66.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 64.099999999999994 110.844 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.44 -34.2 56.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 73.150000000000006 111.101 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.4 t -80.14 -31.1 39.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.245 -0.434 . . . . 62.399999999999999 110.906 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -77.84 -25.64 48.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.097 -0.502 . . . . 63.229999999999997 110.838 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.701 ' CD1' HD12 ' A' ' 127' ' ' LEU . 47.7 mt -101.23 -59.73 3.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 61.130000000000003 111.121 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.694 ' CE2' HD22 ' A' ' 83' ' ' LEU . 7.7 m-85 -77.3 -61.12 2.09 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 75.430000000000007 110.898 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.78 50.07 0.71 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.767 -0.73 . . . . 44.310000000000002 112.486 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -78.77 -38.62 23.25 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 41.520000000000003 112.474 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.407 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 104.79 166.41 24.28 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.738 -0.744 . . . . 71.530000000000001 112.471 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.496 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.9 p -51.76 -50.66 31.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.892 0.377 . . . . 62.219999999999999 111.101 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.496 ' N ' HG13 ' A' ' 96' ' ' VAL . 81.4 m-20 -86.91 38.65 0.81 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 71.140000000000001 110.917 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 95' ' ' GLY . . . -64.19 -76.46 0.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 55.140000000000001 111.08 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -43.33 -40.45 3.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.218 -0.446 . . . . 75.239999999999995 110.891 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.8 m -60.09 -75.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 74.310000000000002 110.874 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.626 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 30.9 mtt180 -49.84 -45.82 50.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 64.230000000000004 110.918 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.724 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.3 m-85 -55.65 -37.28 68.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.197 -0.456 . . . . 64.349999999999994 110.904 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -51.83 -29.69 20.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.493 . . . . 74.530000000000001 110.856 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.8 -22.29 12.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 61.219999999999999 110.94 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.65 26.9 9.45 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.782 -0.723 . . . . 73.049999999999997 112.504 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -98.19 -5.85 32.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.857 0.361 . . . . 71.230000000000004 110.889 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.626 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -110.83 9.22 22.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.136 -0.484 . . . . 22.02 111.07 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.551 ' HB2' HD11 ' A' ' 114' ' ' ILE . 2.0 pt20 -125.07 57.35 15.83 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.604 0.716 . . . . 71.140000000000001 110.835 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.532 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.0 Cg_endo -69.8 36.08 0.23 Allowed 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.656 2.238 . . . . 64.450000000000003 112.394 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.777 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 1.7 t-80 74.1 31.99 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.547 0.689 . . . . 74.340000000000003 110.849 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.777 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.6 Cg_endo -69.74 -163.83 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.71 2.273 . . . . 74.129999999999995 112.324 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 20.2 m -85.67 -29.58 23.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.445 . . . . 63.140000000000001 110.884 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.581 HG23 ' HB3' ' A' ' 92' ' ' PHE . 22.0 m -53.7 -50.84 65.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.113 -0.494 . . . . 73.420000000000002 111.14 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.551 HD11 ' HB2' ' A' ' 108' ' ' GLN . 39.3 mm -51.06 -42.61 24.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.249 -0.432 . . . . 62.530000000000001 111.094 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.534 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -68.08 -29.84 68.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 73.219999999999999 110.89 179.879 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.534 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.5 mp -78.82 -42.2 28.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.242 -0.435 . . . . 74.040000000000006 110.912 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.792 HD13 HG22 ' A' ' 74' ' ' ILE . 16.3 mt -64.06 -48.8 74.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 65.230000000000004 110.954 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.593 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.0 ptp180 -52.77 -34.63 54.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 60.539999999999999 110.918 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.593 HG13 ' HG3' ' A' ' 118' ' ' ARG . 29.3 m -93.66 -13.95 8.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 73.219999999999999 111.114 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.756 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -77.62 -40.2 42.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.111 -0.495 . . . . 72.209999999999994 110.899 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.611 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.5 OUTLIER -50.03 -31.1 12.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 72.409999999999997 110.852 179.932 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.51 -20.63 18.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.134 -0.485 . . . . 73.219999999999999 110.929 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.756 ' O ' HD13 ' A' ' 120' ' ' LEU . 50.3 m-70 -129.01 89.56 48.29 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.643 0.735 . . . . 61.530000000000001 110.854 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.701 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.2 Cg_endo -69.72 1.05 4.76 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.703 2.269 . . . . 63.340000000000003 112.334 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -114.53 -12.51 12.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 74.540000000000006 110.932 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.687 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.8 tp -53.85 -47.76 70.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.082 -0.508 . . . . 71.219999999999999 110.979 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.701 HD12 ' CD1' ' A' ' 91' ' ' ILE . 2.6 pt? -50.5 -29.21 9.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 64.0 110.955 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.474 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.59 -26.68 24.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.183 -0.462 . . . . 73.409999999999997 110.873 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.419 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.9 OUTLIER -95.52 4.1 53.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.446 . . . . 71.439999999999998 110.917 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.687 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.3 pt -123.16 -34.7 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 75.140000000000001 111.121 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.474 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 2.8 ptt-85 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 65.420000000000002 110.902 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 mmt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.864 0.364 . . . . 71.030000000000001 110.85 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.67 -168.81 0.39 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.272 -0.422 . . . . 75.439999999999998 110.877 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 p -179.45 61.18 0.12 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.579 0.704 . . . . 43.340000000000003 110.847 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.73 -5.41 16.12 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.706 2.271 . . . . 71.420000000000002 112.319 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.571 HG12 ' N ' ' A' ' 6' ' ' CYS . 1.7 t -72.0 -60.52 2.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 73.209999999999994 111.132 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.571 ' N ' HG12 ' A' ' 5' ' ' VAL . 0.5 OUTLIER -124.23 -17.91 6.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 61.32 110.906 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 63.85 72.57 0.46 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 72.329999999999998 110.87 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -131.29 -75.55 0.52 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.146 -0.479 . . . . 75.219999999999999 110.934 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -94.3 -117.22 2.85 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.727 -0.749 . . . . 52.109999999999999 112.515 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.438 ' HG2' HG22 ' A' ' 38' ' ' VAL . 7.0 pt-20 -170.84 93.94 0.19 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.86 0.362 . . . . 70.420000000000002 110.891 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.542 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -59.23 103.06 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.466 . . . . 75.519999999999996 110.852 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.7 p -144.28 129.32 14.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.282 -0.417 . . . . 64.129999999999995 111.169 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.603 ' N ' HD23 ' A' ' 35' ' ' LEU . 9.9 p -48.31 131.8 16.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.147 -0.479 . . . . 73.310000000000002 110.813 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.42 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.98 79.72 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.748 -0.739 . . . . 74.040000000000006 112.46 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.42 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.0 144.85 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.913 0.387 . . . . 74.439999999999998 111.115 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.08 -165.61 1.76 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.475 . . . . 73.340000000000003 110.889 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.69 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -94.62 116.91 29.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 75.120000000000005 110.911 179.867 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.745 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.9 mm -108.83 90.76 7.99 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.652 0.739 . . . . 71.030000000000001 111.134 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.525 ' HA ' HG22 ' A' ' 28' ' ' VAL . 54.3 Cg_endo -69.7 96.93 0.61 Allowed 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.72 2.28 . . . . 61.100000000000001 112.332 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -64.98 -36.41 84.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.294 -0.412 . . . . 63.409999999999997 110.861 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.55 HG21 ' HG2' ' A' ' 25' ' ' ARG . 58.7 m -128.2 151.64 49.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 61.119999999999997 111.162 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -152.27 41.69 0.64 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.438 . . . . 73.400000000000006 110.908 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.56 -39.61 1.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.132 -0.485 . . . . 71.450000000000003 110.887 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -158.53 -45.14 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.76 -0.734 . . . . 64.209999999999994 112.545 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.55 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -105.71 44.8 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.892 0.377 . . . . 74.319999999999993 110.915 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.484 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 0.5 OUTLIER -51.75 118.66 3.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 73.319999999999993 110.908 179.984 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.416 HG23 ' O ' ' A' ' 27' ' ' THR . 1.8 t -132.91 92.36 3.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.233 -0.439 . . . . 73.420000000000002 111.12 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.69 HG11 ' HB2' ' A' ' 17' ' ' ASP . 59.1 t -76.84 128.95 37.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 73.310000000000002 111.062 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.75 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.44 52.14 2.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 62.310000000000002 110.951 179.937 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.407 ' C ' ' O ' ' A' ' 29' ' ' LEU . 32.4 mttp -36.89 107.38 0.06 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 71.219999999999999 110.908 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.05 50.15 0.4 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.715 -0.755 . . . . 72.209999999999994 112.55 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.61 HD11 ' CB ' ' A' ' 29' ' ' LEU . 20.3 mm -108.89 93.14 2.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.836 0.351 . . . . 61.5 111.152 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -76.24 152.92 36.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.464 . . . . 61.350000000000001 110.817 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.96 -108.47 0.31 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.717 -0.754 . . . . 52.539999999999999 112.479 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.756 HD12 ' HB ' ' A' ' 44' ' ' ILE . 56.0 mt -156.92 85.98 0.97 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.816 0.341 . . . . 71.400000000000006 110.956 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.468 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.23 160.57 32.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 74.140000000000001 110.926 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.3 t -162.78 -41.0 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 73.400000000000006 110.885 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.438 HG22 ' HG2' ' A' ' 10' ' ' GLU . 4.3 m -127.99 -47.38 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.212 -0.449 . . . . 53.439999999999998 111.149 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.403 ' N ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -85.9 170.0 12.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.134 -0.484 . . . . 71.530000000000001 110.883 179.926 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -136.43 8.47 3.13 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.241 -0.436 . . . . 74.129999999999995 110.928 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -97.84 -63.45 1.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 54.200000000000003 110.896 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.442 ' OE1' HG11 ' A' ' 5' ' ' VAL . 6.1 tp10 -77.03 60.96 1.91 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 65.019999999999996 110.922 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.2 p -99.65 161.98 13.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 74.120000000000005 110.816 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.756 ' HB ' HD12 ' A' ' 35' ' ' LEU . 23.2 mm -144.22 140.21 24.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.091 -0.504 . . . . 74.120000000000005 111.055 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.6 mtm -144.89 129.98 18.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.138 -0.483 . . . . 73.230000000000004 110.92 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.7 m-20 -83.38 -169.79 2.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 64.129999999999995 110.877 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.62 -57.8 10.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 53.329999999999998 110.877 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -56.16 22.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.439 . . . . 74.319999999999993 110.905 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.64 -60.1 3.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.12 -0.491 . . . . 70.329999999999998 110.973 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.3 t -54.2 -39.38 66.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 71.310000000000002 110.834 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.44 -45.88 87.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.097 -0.501 . . . . 72.140000000000001 110.924 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.74 -59.29 4.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 63.450000000000003 111.1 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.438 ' O ' HG13 ' A' ' 57' ' ' VAL . 16.8 t80 -53.42 -48.37 68.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.226 -0.443 . . . . 75.510000000000005 110.861 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.432 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.93 -48.66 77.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 72.25 110.834 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.16 -41.28 62.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.288 -0.414 . . . . 62.539999999999999 111.109 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.75 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -70.6 -66.81 0.56 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.175 -0.466 . . . . 50.130000000000003 110.893 -179.938 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.467 HG12 HD21 ' A' ' 29' ' ' LEU . 13.5 m -47.28 -36.38 4.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.247 -0.433 . . . . 74.129999999999995 111.078 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -69.35 -52.94 22.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 73.219999999999999 110.865 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.56 -49.84 55.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.445 . . . . 72.219999999999999 111.122 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -65.86 -49.26 68.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.285 -0.416 . . . . 72.140000000000001 110.816 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -48.98 -44.03 40.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 72.019999999999996 110.834 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.88 -56.45 7.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 75.129999999999995 111.081 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -50.43 -43.3 54.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 54.299999999999997 110.882 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.0 p -77.84 -24.48 14.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.113 -0.494 . . . . 72.400000000000006 111.143 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -17.51 53.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.179 -0.464 . . . . 74.219999999999999 110.893 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.24 -19.6 61.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.116 -0.493 . . . . 75.049999999999997 111.151 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -50.98 -75.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.184 -0.462 . . . . 75.409999999999997 110.937 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . 1.043 HG22 HG13 ' A' ' 69' ' ' VAL . 81.9 m -120.01 -77.99 0.59 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.092 -0.504 . . . . 74.540000000000006 111.122 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 1.043 HG13 HG22 ' A' ' 68' ' ' THR . 4.7 m -139.51 -177.82 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.457 . . . . 73.319999999999993 111.144 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.54 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -104.56 159.59 28.82 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.598 0.713 . . . . 43.119999999999997 111.143 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.733 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.1 Cg_endo -69.77 -6.86 19.61 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.671 2.248 . . . . 72.519999999999996 112.385 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.93 -40.99 10.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 71.530000000000001 110.884 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -56.71 -61.13 2.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.476 . . . . 71.329999999999998 110.885 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.734 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.28 -68.87 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 74.209999999999994 111.176 179.943 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.1 m -48.73 -38.7 10.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.456 . . . . 71.120000000000005 111.109 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.1 mtmt -60.18 -40.17 89.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 74.409999999999997 110.845 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.526 HG22 ' HB2' ' A' ' 121' ' ' ASP . 82.3 t -69.58 -38.18 76.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 74.5 111.174 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -68.27 -35.39 77.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 54.240000000000002 110.882 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.0 pttt -88.06 -19.33 27.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.485 . . . . 74.109999999999999 110.923 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.431 ' HG2' HD23 ' A' ' 81' ' ' LEU . 0.7 OUTLIER -74.74 -51.73 13.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.446 . . . . 71.230000000000004 110.899 179.857 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.812 ' HB2' HD23 ' A' ' 83' ' ' LEU . 7.8 mt -92.21 14.58 15.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.449 . . . . 64.349999999999994 110.842 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.3 m 50.58 43.45 27.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 54.039999999999999 110.825 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.812 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.3 mm? -78.68 86.21 4.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.129 -0.487 . . . . 70.209999999999994 110.909 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.641 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.91 156.04 0.16 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.203 -0.453 . . . . 63.520000000000003 111.049 179.98 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -57.73 -22.49 46.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 75.239999999999995 110.881 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -79.85 -52.31 8.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 73.010000000000005 110.814 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.641 ' H ' HG23 ' A' ' 84' ' ' THR . 5.1 tp10 -62.67 -56.16 20.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.265 -0.425 . . . . 64.099999999999994 110.861 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.473 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -52.6 -34.32 50.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 73.150000000000006 111.127 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 91.9 p -80.95 -27.71 35.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.2 -0.454 . . . . 62.399999999999999 110.849 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -80.52 -26.66 37.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.48 . . . . 63.229999999999997 110.938 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.775 HD12 ' HB3' ' A' ' 131' ' ' ARG . 22.4 mm -101.29 -56.46 5.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.133 -0.485 . . . . 61.130000000000003 111.119 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.567 ' HB3' HG23 ' A' ' 113' ' ' THR . 4.7 m-85 -80.86 -62.93 1.52 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 75.430000000000007 110.933 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 110.95 52.38 0.57 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.692 -0.766 . . . . 44.310000000000002 112.469 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -80.71 -40.98 11.43 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.762 -0.733 . . . . 41.520000000000003 112.509 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 101.96 -179.87 27.55 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.746 -0.74 . . . . 71.530000000000001 112.513 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.528 HG13 ' N ' ' A' ' 97' ' ' ASN . 5.3 p -67.08 -50.55 62.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.822 0.344 . . . . 62.219999999999999 111.167 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.528 ' N ' HG13 ' A' ' 96' ' ' VAL . 8.9 p30 -86.24 31.9 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 71.140000000000001 110.937 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.63 -75.9 0.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 55.140000000000001 111.08 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -39.72 -47.34 2.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 75.239999999999995 110.87 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 40.2 t -56.92 -74.78 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 74.310000000000002 110.921 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.513 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 36.7 mtt180 -47.07 -54.48 10.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.124 -0.489 . . . . 64.230000000000004 110.87 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.616 ' HB3' HD12 ' A' ' 74' ' ' ILE . 13.2 m-85 -49.83 -37.68 31.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.45 . . . . 64.349999999999994 110.863 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -55.43 -40.65 71.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 74.530000000000001 110.904 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.26 -17.34 26.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 61.219999999999999 110.871 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.96 25.7 18.99 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.768 -0.729 . . . . 73.049999999999997 112.498 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -93.46 -27.66 16.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.831 0.348 . . . . 71.230000000000004 110.816 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.513 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -100.61 18.7 18.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 22.02 111.083 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.494 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -121.65 53.74 4.23 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.62 0.724 . . . . 71.140000000000001 110.889 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 54.0 Cg_endo -69.81 28.51 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.668 2.245 . . . . 64.450000000000003 112.347 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.718 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.5 m-70 70.2 36.87 0.12 Allowed Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.577 0.703 . . . . 74.340000000000003 110.88 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.718 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.5 Cg_endo -69.71 -165.37 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.64 2.227 . . . . 74.129999999999995 112.405 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.0 p -83.05 -32.64 26.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.267 -0.424 . . . . 63.140000000000001 110.913 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.567 HG23 ' HB3' ' A' ' 92' ' ' PHE . 18.5 m -49.17 -43.48 42.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.144 -0.48 . . . . 73.420000000000002 111.167 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.439 HD11 ' HG2' ' A' ' 108' ' ' GLN . 24.7 mm -58.96 -44.4 90.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 62.530000000000001 111.082 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.644 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -64.47 -28.85 69.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.466 . . . . 73.219999999999999 110.89 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.644 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.5 mp -81.14 -42.52 20.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.266 -0.424 . . . . 74.040000000000006 110.978 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.734 HD13 HG22 ' A' ' 74' ' ' ILE . 18.2 mt -61.54 -49.28 77.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 65.230000000000004 110.852 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.56 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.7 ptp180 -52.11 -39.41 59.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 60.539999999999999 110.864 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.56 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.8 m -88.34 -13.4 9.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.226 -0.443 . . . . 73.219999999999999 111.128 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.744 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -78.54 -39.88 36.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.162 -0.472 . . . . 72.209999999999994 110.923 179.979 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.526 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.4 OUTLIER -50.16 -31.33 13.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 72.409999999999997 110.881 179.857 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.43 -19.49 18.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.151 -0.477 . . . . 73.219999999999999 110.963 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.744 ' O ' HD13 ' A' ' 120' ' ' LEU . 46.5 m-70 -130.05 88.46 48.41 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.613 0.72 . . . . 61.530000000000001 110.867 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.658 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.4 Cg_endo -69.83 2.74 3.3 Favored 'Trans proline' 0 C--N 1.342 0.231 0 C-N-CA 122.652 2.235 . . . . 63.340000000000003 112.311 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -116.83 -11.68 10.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.274 -0.421 . . . . 74.540000000000006 110.837 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.668 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.4 tp -53.85 -46.38 71.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 71.219999999999999 110.883 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.523 HD13 HD11 ' A' ' 83' ' ' LEU . 1.6 pt? -50.11 -29.24 8.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 64.0 110.869 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.52 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 6.5 m120 -86.57 -27.48 23.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 73.409999999999997 110.928 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.426 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -94.54 4.58 53.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.19 -0.459 . . . . 71.439999999999998 110.919 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.668 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.0 pt -123.84 -35.1 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 75.140000000000001 111.146 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.775 ' HB3' HD12 ' A' ' 91' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 65.420000000000002 110.936 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 mmt . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.836 0.351 . . . . 71.030000000000001 110.849 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.56 -169.49 0.44 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.246 -0.434 . . . . 75.439999999999998 110.893 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 1.7 p 178.7 55.67 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.385 0 CA-C-O 121.516 0.674 . . . . 43.340000000000003 110.899 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 53.4 Cg_endo -69.79 -8.67 24.2 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.709 2.272 . . . . 71.420000000000002 112.277 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.665 HG21 ' CD ' ' A' ' 42' ' ' GLU . 6.8 m -67.45 -49.56 70.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 73.209999999999994 111.132 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.463 ' N ' HG23 ' A' ' 5' ' ' VAL . 1.2 m -133.19 -20.96 2.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.171 -0.468 . . . . 61.32 110.893 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 66.65 89.01 0.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.216 -0.447 . . . . 72.329999999999998 110.909 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.426 ' NE2' ' HB3' ' A' ' 6' ' ' CYS . 14.2 mp0 -132.26 -65.85 0.72 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 75.219999999999999 110.94 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.508 ' HA3' HG23 ' A' ' 38' ' ' VAL . . . -129.55 -96.0 0.78 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.745 -0.74 . . . . 52.109999999999999 112.441 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.589 ' HG2' HG22 ' A' ' 38' ' ' VAL . 8.6 pt-20 -177.0 95.28 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.87 0.367 . . . . 70.420000000000002 110.86 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.565 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -62.45 102.94 0.36 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 75.519999999999996 110.909 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.7 p -144.28 129.22 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.28 -0.418 . . . . 64.129999999999995 111.166 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.628 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -48.65 130.28 17.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.154 -0.476 . . . . 73.310000000000002 110.861 -179.793 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.421 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.66 80.71 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.752 -0.737 . . . . 74.040000000000006 112.487 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.421 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.3 146.21 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.851 0.358 . . . . 74.439999999999998 111.125 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.1 -165.49 1.73 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.123 -0.489 . . . . 73.340000000000003 110.914 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.654 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -95.62 117.76 31.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.265 -0.425 . . . . 75.120000000000005 110.846 179.912 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.73 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.4 mm -108.21 91.42 8.07 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.623 0.725 . . . . 71.030000000000001 111.13 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.438 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.7 Cg_endo -69.73 96.76 0.6 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.662 2.241 . . . . 61.100000000000001 112.322 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.483 ' HB3' HG23 ' A' ' 27' ' ' THR . 10.7 t80 -63.11 -37.69 88.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.198 -0.455 . . . . 63.409999999999997 110.882 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.478 HG23 ' HD3' ' A' ' 23' ' ' ARG . 11.0 m -127.55 146.97 50.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 61.119999999999997 111.153 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -142.86 38.5 1.47 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.46 . . . . 73.400000000000006 110.86 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.478 ' HD3' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -129.64 -40.42 1.4 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.192 -0.458 . . . . 71.450000000000003 110.854 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -156.41 -58.98 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.691 -0.766 . . . . 64.209999999999994 112.459 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.475 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -90.28 47.04 1.39 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.872 0.367 . . . . 74.319999999999993 110.926 -179.878 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.406 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 11.8 tttm -54.61 113.35 1.27 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 73.319999999999993 110.936 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.483 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.8 t -127.13 92.68 3.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.241 -0.436 . . . . 73.420000000000002 111.092 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.654 HG11 ' HB2' ' A' ' 17' ' ' ASP . 44.3 t -77.06 126.87 38.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 73.310000000000002 111.133 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.742 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.64 51.19 2.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 62.310000000000002 110.921 179.975 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.41 ' C ' ' O ' ' A' ' 29' ' ' LEU . 22.8 mttp -37.73 108.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.466 . . . . 71.219999999999999 110.851 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.48 47.02 0.43 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.716 -0.754 . . . . 72.209999999999994 112.473 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.566 HD11 ' HB3' ' A' ' 29' ' ' LEU . 15.5 mm -107.92 90.95 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.824 0.345 . . . . 61.5 111.168 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.54 153.97 40.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.195 -0.457 . . . . 61.350000000000001 110.865 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.46 -109.0 0.32 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.714 -0.755 . . . . 52.539999999999999 112.445 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.776 HD12 ' HB ' ' A' ' 44' ' ' ILE . 56.0 mt -156.79 86.29 0.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.857 0.36 . . . . 71.400000000000006 110.885 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.433 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.34 163.16 33.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 74.140000000000001 110.854 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.1 t -164.31 -39.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 73.400000000000006 110.967 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.589 HG22 ' HG2' ' A' ' 10' ' ' GLU . 15.7 m -131.1 -44.57 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.133 -0.485 . . . . 53.439999999999998 111.115 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.432 ' N ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -89.47 169.7 11.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 71.530000000000001 110.787 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 98.2 m -134.94 7.14 3.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.153 -0.476 . . . . 74.129999999999995 110.934 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -94.03 -65.07 1.01 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.176 -0.465 . . . . 54.200000000000003 110.895 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.665 ' CD ' HG21 ' A' ' 5' ' ' VAL . 16.0 tp10 -76.21 61.29 1.59 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.133 -0.485 . . . . 65.019999999999996 110.929 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.9 p -100.13 158.4 15.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 74.120000000000005 110.902 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.776 ' HB ' HD12 ' A' ' 35' ' ' LEU . 20.6 mm -145.33 140.17 22.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 74.120000000000005 111.133 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.5 mtt -143.37 140.55 30.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 73.230000000000004 110.848 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 35.5 m-20 -88.54 -169.88 2.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 64.129999999999995 110.861 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -61.13 2.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.179 -0.464 . . . . 53.329999999999998 110.867 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.26 -57.29 9.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 74.319999999999993 110.846 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.04 -58.25 6.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 70.329999999999998 110.866 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.8 t -53.48 -42.2 67.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 71.310000000000002 110.844 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -57.46 -45.02 85.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.146 -0.479 . . . . 72.140000000000001 110.866 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.03 -61.71 2.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 63.450000000000003 111.114 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.429 ' CZ ' HG11 ' A' ' 57' ' ' VAL . 15.8 t80 -52.6 -48.59 66.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 75.510000000000005 110.779 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.436 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -61.52 -48.9 78.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.245 -0.434 . . . . 72.25 110.878 179.959 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.79 -43.27 62.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.236 -0.438 . . . . 62.539999999999999 111.128 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.742 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -68.76 -66.6 0.55 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 50.130000000000003 110.945 -179.949 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.436 HG22 ' HA ' ' A' ' 54' ' ' MET . 15.0 m -47.5 -36.71 4.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.13 -0.486 . . . . 74.129999999999995 111.113 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 mmmt -67.02 -55.96 12.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 73.219999999999999 110.906 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.29 -53.05 23.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 72.219999999999999 111.145 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.613 ' O ' HG13 ' A' ' 64' ' ' VAL . 0.2 OUTLIER -62.85 -48.53 78.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 72.140000000000001 110.965 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -50.25 -38.47 40.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.126 -0.488 . . . . 72.019999999999996 110.855 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.67 -53.67 12.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.139 -0.482 . . . . 75.129999999999995 111.103 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.1 -26.95 63.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.152 -0.477 . . . . 54.299999999999997 110.864 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.613 HG13 ' O ' ' A' ' 60' ' ' PHE . 9.0 m -93.87 -19.56 6.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 72.400000000000006 111.109 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.84 -19.41 41.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 74.219999999999999 110.887 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.81 -22.18 34.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 75.049999999999997 111.108 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -50.35 -75.64 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.209 -0.45 . . . . 75.409999999999997 110.845 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.841 HG22 HG13 ' A' ' 69' ' ' VAL . 97.6 m -128.26 -78.1 0.57 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 74.540000000000006 111.169 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.841 HG13 HG22 ' A' ' 68' ' ' THR . 16.8 m -145.19 178.0 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 73.319999999999993 111.135 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.548 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -100.81 159.91 28.24 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.542 0.687 . . . . 43.119999999999997 111.132 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.74 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.3 Cg_endo -69.7 -6.78 19.4 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.657 2.238 . . . . 72.519999999999996 112.339 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -92.34 -40.24 11.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.271 -0.422 . . . . 71.530000000000001 110.841 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -57.77 -60.75 3.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 71.329999999999998 110.85 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.74 HD11 ' HA ' ' A' ' 71' ' ' PRO . 0.3 OUTLIER -44.18 -68.46 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.451 . . . . 74.209999999999994 111.126 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.3 m -49.03 -39.61 12.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 71.120000000000005 111.166 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.4 mtmt -59.42 -38.54 80.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 74.409999999999997 110.934 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.443 HG22 ' HB2' ' A' ' 121' ' ' ASP . 98.7 t -71.11 -39.22 73.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 74.5 111.089 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.8 OUTLIER -69.5 -30.59 68.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 54.240000000000002 110.918 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.64 -22.31 21.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.456 . . . . 74.109999999999999 110.853 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -74.14 -50.88 17.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 71.230000000000004 110.953 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.852 HD13 HD12 ' A' ' 120' ' ' LEU . 8.1 mt -90.64 12.68 18.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 64.349999999999994 110.865 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.43 43.01 29.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 54.039999999999999 110.853 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.836 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.3 mm? -78.69 86.28 4.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.125 -0.489 . . . . 70.209999999999994 110.91 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.624 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -46.11 156.75 0.14 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.16 -0.473 . . . . 63.520000000000003 111.103 179.911 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -59.89 -22.69 62.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 75.239999999999995 110.905 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.1 -51.06 10.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 73.010000000000005 110.887 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.624 ' H ' HG23 ' A' ' 84' ' ' THR . 0.9 OUTLIER -66.48 -52.75 42.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 64.099999999999994 110.843 -179.983 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.509 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -54.95 -32.01 61.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.113 -0.494 . . . . 73.150000000000006 111.103 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.4 t -80.44 -35.08 35.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 62.399999999999999 110.869 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -76.3 -23.37 54.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 63.229999999999997 110.878 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.732 ' CD1' HD12 ' A' ' 127' ' ' LEU . 57.1 mt -102.09 -60.68 2.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.142 -0.481 . . . . 61.130000000000003 111.16 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.56 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.8 m-85 -78.51 -63.49 1.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.485 . . . . 75.430000000000007 110.903 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 111.32 47.17 0.76 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.8 -0.715 . . . . 44.310000000000002 112.466 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -69.21 -46.88 56.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.721 -0.752 . . . . 41.520000000000003 112.488 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 111.45 169.53 18.75 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.689 -0.767 . . . . 71.530000000000001 112.48 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.682 HG13 ' H ' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -51.22 -66.6 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.912 0.387 . . . . 62.219999999999999 111.222 179.992 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.682 ' H ' HG13 ' A' ' 96' ' ' VAL . 31.6 m-80 -86.07 40.67 0.88 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.099 -0.5 . . . . 71.140000000000001 110.876 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.76 -73.6 0.1 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 55.140000000000001 111.095 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -40.28 -46.21 2.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.465 . . . . 75.239999999999995 110.912 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.3 m -56.46 -74.74 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.087 -0.506 . . . . 74.310000000000002 110.902 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.522 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 10.1 mtt85 -48.38 -52.79 20.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.08 -0.509 . . . . 64.230000000000004 110.867 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.615 ' HB3' HD12 ' A' ' 74' ' ' ILE . 12.0 m-85 -50.76 -36.27 35.91 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.216 -0.447 . . . . 64.349999999999994 110.925 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -56.12 -39.7 72.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 74.530000000000001 110.862 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.74 -17.64 23.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 61.219999999999999 110.948 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.0 27.15 14.33 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.747 -0.74 . . . . 73.049999999999997 112.502 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.1 m-20 -96.38 -20.57 18.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.794 0.331 . . . . 71.230000000000004 110.911 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.522 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -108.54 17.35 22.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.09 -0.505 . . . . 22.02 111.151 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.483 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.1 OUTLIER -120.56 54.56 3.7 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.63 0.729 . . . . 71.140000000000001 110.935 -179.949 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.429 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 54.1 Cg_endo -69.77 31.64 0.19 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.686 2.257 . . . . 64.450000000000003 112.361 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.696 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.0 m-70 69.02 38.46 0.18 Allowed Pre-proline 0 C--N 1.331 -0.237 0 CA-C-O 121.557 0.694 . . . . 74.340000000000003 110.854 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.696 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.5 Cg_endo -69.83 -165.71 0.16 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.619 2.212 . . . . 74.129999999999995 112.354 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 12.0 m -83.65 -33.54 25.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.237 -0.438 . . . . 63.140000000000001 110.904 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.56 HG23 ' HB3' ' A' ' 92' ' ' PHE . 15.5 m -48.87 -40.79 31.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.107 -0.497 . . . . 73.420000000000002 111.174 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.436 HD11 ' CG ' ' A' ' 108' ' ' GLN . 27.2 mm -61.08 -43.8 96.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 62.530000000000001 111.183 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.665 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -65.08 -28.91 69.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.084 -0.507 . . . . 73.219999999999999 110.843 179.867 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.665 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.5 mp -81.46 -42.98 19.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.231 -0.441 . . . . 74.040000000000006 110.911 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.614 HD13 HG22 ' A' ' 74' ' ' ILE . 30.2 mt -62.02 -49.36 76.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.185 -0.461 . . . . 65.230000000000004 110.856 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.577 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.6 ptp180 -51.61 -38.48 54.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 60.539999999999999 110.886 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.577 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.3 m -89.68 -13.99 9.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.169 -0.469 . . . . 73.219999999999999 111.134 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.852 HD12 HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -77.62 -40.82 40.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 72.209999999999994 110.89 -179.993 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.443 ' HB2' HG22 ' A' ' 77' ' ' VAL . 7.6 t70 -49.32 -31.98 10.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.199 -0.455 . . . . 72.409999999999997 110.926 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.46 -21.2 17.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.147 -0.479 . . . . 73.219999999999999 110.884 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.755 ' O ' HD13 ' A' ' 120' ' ' LEU . 38.8 m80 -127.56 88.21 54.2 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.606 0.717 . . . . 61.530000000000001 110.871 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.604 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.1 Cg_endo -69.74 3.53 2.71 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.716 2.277 . . . . 63.340000000000003 112.37 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -117.24 -12.69 10.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 74.540000000000006 110.937 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.663 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.2 tp -54.11 -46.79 72.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 71.219999999999999 110.954 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.732 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.41 -29.68 6.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.489 . . . . 64.0 110.903 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.511 HD21 HH12 ' A' ' 131' ' ' ARG . 6.3 m120 -86.27 -28.6 23.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 73.409999999999997 110.886 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.426 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -93.18 4.68 53.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.45 . . . . 71.439999999999998 110.91 -179.993 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.1 pt -123.81 -35.01 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 75.140000000000001 111.14 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.511 HH12 HD21 ' A' ' 128' ' ' ASN . 2.1 ptt-85 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 65.420000000000002 110.841 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.673 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 1.3 mmt . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.835 0.35 . . . . 71.030000000000001 110.871 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.82 -169.39 0.41 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 75.439999999999998 110.846 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.9 p 175.92 58.66 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.614 0.721 . . . . 43.340000000000003 110.924 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 1.15 4.67 Favored 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.698 2.265 . . . . 71.420000000000002 112.349 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.466 HG21 ' CB ' ' A' ' 42' ' ' GLU . 28.6 m -89.59 -41.97 14.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 73.209999999999994 111.213 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.438 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.7 OUTLIER -125.45 -31.37 3.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.152 -0.476 . . . . 61.32 110.896 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 66.6 53.42 0.93 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 72.329999999999998 110.85 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 85.7 mm-40 -112.38 -76.08 0.6 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.247 -0.433 . . . . 75.219999999999999 110.882 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.91 -109.47 3.27 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.702 -0.761 . . . . 52.109999999999999 112.449 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.673 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 7.6 pt-20 -177.46 98.3 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.888 0.375 . . . . 70.420000000000002 110.87 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.569 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -55.72 106.56 0.26 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.09 -0.505 . . . . 75.519999999999996 110.873 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.1 p -149.16 130.67 5.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 64.129999999999995 111.161 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.53 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -45.93 127.98 8.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.433 . . . . 73.310000000000002 110.893 -179.843 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.97 79.79 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.707 -0.758 . . . . 74.040000000000006 112.491 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.416 HD12 ' N ' ' A' ' 15' ' ' ILE . 0.7 OUTLIER -36.97 146.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.881 0.372 . . . . 74.439999999999998 111.092 -179.931 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.58 -168.28 2.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.187 -0.46 . . . . 73.340000000000003 110.909 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -93.98 116.21 28.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 75.120000000000005 110.889 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.776 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.2 mm -107.98 90.66 6.8 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.572 0.701 . . . . 71.030000000000001 111.157 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.514 ' HB3' HG12 ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.75 104.19 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.657 2.238 . . . . 61.100000000000001 112.383 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -70.87 -30.97 67.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 63.409999999999997 110.926 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.5 HG21 ' HG2' ' A' ' 25' ' ' ARG . 21.6 m -128.21 147.44 50.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 61.119999999999997 111.167 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -146.35 30.49 1.02 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 73.400000000000006 110.884 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.421 ' HD3' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -118.63 -44.81 2.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.116 -0.493 . . . . 71.450000000000003 110.878 -179.873 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -151.22 -58.08 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.774 -0.727 . . . . 64.209999999999994 112.473 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.5 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -91.73 45.46 1.23 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.381 . . . . 74.319999999999993 110.869 -179.835 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.402 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 9.1 tttm -49.66 110.85 0.42 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 73.319999999999993 110.872 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.637 HG21 ' CD1' ' A' ' 60' ' ' PHE . 2.2 t -132.13 93.28 3.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 73.420000000000002 111.131 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.514 HG12 ' HB3' ' A' ' 19' ' ' PRO . 0.8 OUTLIER -80.82 139.83 17.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 73.310000000000002 111.13 179.924 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.776 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -86.09 63.6 8.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 62.310000000000002 110.921 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.0 mttp -42.26 104.55 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 71.219999999999999 110.918 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.493 ' O ' HD13 ' A' ' 32' ' ' ILE . . . 117.42 60.49 0.3 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.759 -0.734 . . . . 72.209999999999994 112.495 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.593 HD11 ' CB ' ' A' ' 29' ' ' LEU . 18.2 mm -116.78 92.34 2.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.807 0.337 . . . . 61.5 111.135 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.52 156.66 36.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.274 -0.421 . . . . 61.350000000000001 110.828 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 164.53 -107.66 0.31 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.713 -0.755 . . . . 52.539999999999999 112.464 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.716 HD12 ' HB ' ' A' ' 44' ' ' ILE . 49.8 mt -156.47 83.33 0.98 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.91 0.385 . . . . 71.400000000000006 110.916 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.538 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -165.66 168.79 15.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 74.140000000000001 110.935 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.1 t -177.06 -35.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 73.400000000000006 110.879 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.69 -49.01 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 53.439999999999998 111.134 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.79 173.93 7.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 71.530000000000001 110.786 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.8 p -147.8 36.3 0.86 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 74.129999999999995 110.843 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -112.36 -75.67 0.6 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 54.200000000000003 110.913 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.466 ' CB ' HG21 ' A' ' 5' ' ' VAL . 1.8 pm0 -79.06 60.4 2.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 65.019999999999996 110.912 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.2 p -83.73 159.48 21.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.463 . . . . 74.120000000000005 110.837 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.716 ' HB ' HD12 ' A' ' 35' ' ' LEU . 28.4 mm -142.76 140.65 27.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.056 -0.52 . . . . 74.120000000000005 111.123 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.1 mtt -145.66 141.16 27.85 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 73.230000000000004 110.88 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.0 m-20 -86.07 -169.93 2.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 64.129999999999995 110.908 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 6.6 mmpt? -57.8 -59.62 4.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 53.329999999999998 110.878 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.93 -57.76 8.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.26 -0.427 . . . . 74.319999999999993 110.925 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.58 -59.03 4.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.19 -0.459 . . . . 70.329999999999998 110.882 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.6 t -52.79 -38.22 60.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.134 -0.485 . . . . 71.310000000000002 110.871 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.54 -43.24 99.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.096 -0.502 . . . . 72.140000000000001 110.902 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.89 -58.78 5.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 63.450000000000003 111.073 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.505 ' O ' HG13 ' A' ' 57' ' ' VAL . 15.1 t80 -53.63 -47.64 70.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.251 -0.431 . . . . 75.510000000000005 110.937 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -50.98 67.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.117 -0.492 . . . . 72.25 110.877 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.02 -40.57 58.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 62.539999999999999 111.071 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.736 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.7 OUTLIER -70.29 -67.48 0.49 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 50.130000000000003 110.876 -179.889 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.505 HG13 ' O ' ' A' ' 53' ' ' PHE . 9.3 m -48.01 -34.58 4.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.227 -0.442 . . . . 74.129999999999995 111.13 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.3 mmmm -69.19 -56.71 6.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 73.219999999999999 110.882 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -48.99 -51.89 28.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.248 -0.433 . . . . 72.219999999999999 111.07 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.693 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.2 OUTLIER -62.83 -48.66 78.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.263 -0.426 . . . . 72.140000000000001 110.853 -179.875 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.54 -37.57 40.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.494 . . . . 72.019999999999996 110.866 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.0 -52.82 15.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 75.129999999999995 111.133 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.46 -31.31 67.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 54.299999999999997 110.791 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.693 HG22 ' O ' ' A' ' 60' ' ' PHE . 30.9 m -91.45 -16.54 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 72.400000000000006 111.087 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.91 -17.82 58.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 74.219999999999999 110.833 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -82.16 -18.45 42.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.435 . . . . 75.049999999999997 111.155 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -51.72 -75.19 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 75.409999999999997 110.866 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.942 HG22 HG13 ' A' ' 69' ' ' VAL . 97.2 m -53.04 -76.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 74.540000000000006 111.162 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.942 HG13 HG22 ' A' ' 68' ' ' THR . 14.7 m -135.85 -172.4 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.208 -0.451 . . . . 73.319999999999993 111.166 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.543 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.71 159.39 30.03 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.535 0.684 . . . . 43.119999999999997 111.124 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.543 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 54.1 Cg_endo -69.73 -7.81 22.01 Favored 'Trans proline' 0 C--N 1.341 0.132 0 C-N-CA 122.681 2.254 . . . . 72.519999999999996 112.367 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -95.77 -38.36 10.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.23 -0.441 . . . . 71.530000000000001 110.917 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -55.71 -61.6 2.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.126 -0.488 . . . . 71.329999999999998 110.859 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.692 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.42 -68.68 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.165 -0.47 . . . . 74.209999999999994 111.094 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.6 m -48.88 -39.03 11.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 71.120000000000005 111.149 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -60.82 -38.52 85.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 74.409999999999997 110.966 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.479 HG22 ' HB2' ' A' ' 121' ' ' ASP . 97.3 t -70.63 -38.29 72.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.455 . . . . 74.5 111.111 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 78' ' ' ARG . 1.1 mtp180 -69.58 -32.63 71.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 54.240000000000002 110.85 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.57 -18.97 24.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 74.109999999999999 110.877 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.463 ' HG2' HD23 ' A' ' 81' ' ' LEU . 2.0 ttmt -76.1 -51.46 12.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.276 -0.42 . . . . 71.230000000000004 110.916 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.817 ' HB2' HD23 ' A' ' 83' ' ' LEU . 8.5 mt -91.39 14.44 14.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 64.349999999999994 110.905 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.49 42.91 29.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.464 . . . . 54.039999999999999 110.904 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.817 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.3 mm? -78.71 84.36 4.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 70.209999999999994 110.895 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.612 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.78 155.92 0.23 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 63.520000000000003 111.177 179.918 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -57.82 -22.52 47.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 75.239999999999995 110.936 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.17 -53.31 7.1 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.174 -0.467 . . . . 73.010000000000005 110.869 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.612 ' H ' HG23 ' A' ' 84' ' ' THR . 4.2 tp10 -64.42 -55.68 19.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 64.099999999999994 110.936 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.536 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -51.22 -35.9 39.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 73.150000000000006 111.094 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 94.5 p -78.61 -32.24 47.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 62.399999999999999 110.82 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -74.62 -28.52 60.92 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.123 -0.49 . . . . 63.229999999999997 110.906 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.778 HD12 ' HB3' ' A' ' 131' ' ' ARG . 17.3 mm -99.9 -61.75 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 61.130000000000003 111.11 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.537 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.3 m-85 -73.42 -63.46 1.19 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 75.430000000000007 110.882 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 117.51 37.94 0.88 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.765 -0.731 . . . . 44.310000000000002 112.549 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -57.54 -52.18 53.41 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.782 -0.723 . . . . 41.520000000000003 112.463 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.11 -154.49 16.62 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.698 -0.763 . . . . 71.530000000000001 112.556 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.6 t -85.14 -67.2 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.882 0.372 . . . . 62.219999999999999 111.065 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -82.11 36.18 0.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.443 . . . . 71.140000000000001 110.923 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.38 -78.77 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.5 . . . . 55.140000000000001 111.076 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -38.09 -43.05 0.71 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 75.239999999999995 110.913 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.2 t -57.39 -76.6 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 74.310000000000002 110.929 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.562 ' HB3' ' HB2' ' A' ' 107' ' ' ALA . 54.6 mtt180 -50.06 -48.97 52.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.481 . . . . 64.230000000000004 110.861 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.498 ' HB3' HD12 ' A' ' 74' ' ' ILE . 8.7 m-85 -52.22 -36.33 51.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.144 -0.48 . . . . 64.349999999999994 110.911 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -55.73 -31.67 62.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.065 -0.516 . . . . 74.530000000000001 110.876 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.44 -17.21 15.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 61.219999999999999 110.899 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.18 26.65 15.44 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.773 -0.727 . . . . 73.049999999999997 112.517 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -99.04 -2.82 36.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.848 0.356 . . . . 71.230000000000004 110.839 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.562 ' HB2' ' HB3' ' A' ' 101' ' ' ARG . . . -121.95 17.09 10.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 22.02 111.139 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.43 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 1.8 pt20 -126.34 55.21 13.0 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.535 0.684 . . . . 71.140000000000001 110.871 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.501 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.9 Cg_endo -69.74 39.09 0.27 Allowed 'Trans proline' 0 C--N 1.341 0.135 0 C-N-CA 122.619 2.213 . . . . 64.450000000000003 112.424 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.734 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 4.0 m-70 70.96 35.31 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.618 0.723 . . . . 74.340000000000003 110.861 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.734 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.5 Cg_endo -69.69 -164.15 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.765 2.31 . . . . 74.129999999999995 112.348 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.29 -27.27 22.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 63.140000000000001 110.844 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.537 HG23 ' HB3' ' A' ' 92' ' ' PHE . 48.1 m -58.74 -41.28 86.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.078 -0.51 . . . . 73.420000000000002 111.161 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.402 HD11 ' HB2' ' A' ' 108' ' ' GLN . 46.3 mm -61.76 -46.31 96.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 62.530000000000001 111.13 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.445 ' HZ2' HG11 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -66.45 -29.05 69.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.136 -0.484 . . . . 73.219999999999999 110.911 179.869 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.458 ' CD2' HD12 ' A' ' 130' ' ' ILE . 5.7 mp -79.64 -42.35 25.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.192 -0.458 . . . . 74.040000000000006 110.845 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.692 HD13 HG22 ' A' ' 74' ' ' ILE . 26.9 mt -62.97 -48.57 78.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 65.230000000000004 110.931 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.592 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.3 ptp180 -53.05 -35.2 59.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 60.539999999999999 110.884 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.592 HG13 ' HG3' ' A' ' 118' ' ' ARG . 30.6 m -93.45 -12.8 8.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 73.219999999999999 111.066 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.744 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -79.02 -39.21 34.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 72.209999999999994 110.897 -179.989 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.479 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.6 OUTLIER -50.61 -30.39 13.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.244 -0.435 . . . . 72.409999999999997 110.801 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.15 -19.42 17.92 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.204 -0.453 . . . . 73.219999999999999 110.89 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.744 ' O ' HD13 ' A' ' 120' ' ' LEU . 46.5 m-70 -130.27 88.29 48.28 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.544 0.687 . . . . 61.530000000000001 110.837 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.651 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.3 Cg_endo -69.69 2.57 3.37 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.724 2.283 . . . . 63.340000000000003 112.351 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -116.81 -11.52 10.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.225 -0.443 . . . . 74.540000000000006 110.925 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.666 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.5 tp -53.87 -46.32 71.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.108 -0.496 . . . . 71.219999999999999 110.884 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.514 HD13 HD11 ' A' ' 83' ' ' LEU . 1.7 pt? -49.97 -29.65 8.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.471 . . . . 64.0 110.922 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.516 HD21 HH12 ' A' ' 131' ' ' ARG . 6.3 m120 -86.34 -27.8 24.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.448 . . . . 73.409999999999997 110.878 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.427 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -93.59 3.69 55.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.185 -0.461 . . . . 71.439999999999998 110.914 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.666 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.7 pt -122.6 -34.82 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.496 . . . . 75.140000000000001 111.124 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.778 ' HB3' HD12 ' A' ' 91' ' ' ILE . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 65.420000000000002 110.833 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.546 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 3.9 mmt . . . . . 0 N--CA 1.458 -0.063 0 CA-C-O 120.841 0.353 . . . . 71.030000000000001 110.88 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.7 -169.31 0.42 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 75.439999999999998 110.915 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 p 176.73 58.26 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.636 0.731 . . . . 43.340000000000003 110.91 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.82 3.66 2.67 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.653 2.235 . . . . 71.420000000000002 112.247 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.5 m -95.05 -42.46 12.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.293 -0.412 . . . . 73.209999999999994 111.131 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.62 -32.53 3.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 61.32 110.835 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.8 m-70 65.37 49.94 1.81 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.466 . . . . 72.329999999999998 110.828 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -111.18 -75.24 0.62 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.442 . . . . 75.219999999999999 110.819 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -102.08 -109.51 3.28 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.768 -0.729 . . . . 52.109999999999999 112.444 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.546 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 9.4 pt-20 -177.29 98.16 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.852 0.358 . . . . 70.420000000000002 110.854 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.573 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -55.78 105.85 0.21 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 75.519999999999996 110.845 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.1 p -148.28 129.93 6.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.169 -0.469 . . . . 64.129999999999995 111.141 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.548 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -45.69 125.28 5.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 73.310000000000002 110.891 -179.863 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -178.0 81.83 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.774 -0.727 . . . . 74.040000000000006 112.564 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.408 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -38.15 148.65 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.873 0.368 . . . . 74.439999999999998 111.12 -179.955 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.41 -164.84 1.44 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.189 -0.459 . . . . 73.340000000000003 110.907 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.664 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -97.2 116.75 29.97 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.243 -0.435 . . . . 75.120000000000005 110.867 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.727 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.2 mm -107.65 91.83 7.85 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.671 0.748 . . . . 71.030000000000001 111.086 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.423 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.6 Cg_endo -69.82 96.08 0.58 Allowed 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.693 2.262 . . . . 61.100000000000001 112.305 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.52 ' HB3' HG23 ' A' ' 27' ' ' THR . 16.3 t80 -60.76 -39.63 89.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.187 -0.461 . . . . 63.409999999999997 110.945 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.44 HG22 ' H ' ' A' ' 23' ' ' ARG . 15.7 m -128.41 144.69 51.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.134 -0.484 . . . . 61.119999999999997 111.064 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -134.13 45.81 2.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 73.400000000000006 110.864 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.44 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -132.57 -68.28 0.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 71.450000000000003 110.874 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.83 -46.62 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.712 -0.756 . . . . 64.209999999999994 112.513 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.435 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.25 39.71 1.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.86 0.362 . . . . 74.319999999999993 110.891 -179.885 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -52.51 118.92 3.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.161 -0.472 . . . . 73.319999999999993 110.909 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.52 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -132.55 93.31 3.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.254 -0.43 . . . . 73.420000000000002 111.15 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.664 HG11 ' HB2' ' A' ' 17' ' ' ASP . 42.9 t -77.45 126.2 37.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 73.310000000000002 111.105 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.743 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.33 51.77 2.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.108 -0.496 . . . . 62.310000000000002 110.89 -180.0 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -38.83 107.03 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 71.219999999999999 110.937 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.8 45.07 0.39 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.713 -0.756 . . . . 72.209999999999994 112.465 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.576 HD11 ' HB3' ' A' ' 29' ' ' LEU . 14.2 mm -106.28 91.0 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.862 0.363 . . . . 61.5 111.118 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.09 158.23 34.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.103 -0.499 . . . . 61.350000000000001 110.878 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 164.81 -106.86 0.28 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.762 -0.733 . . . . 52.539999999999999 112.497 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.743 HD12 ' HB ' ' A' ' 44' ' ' ILE . 45.6 mt -156.68 82.71 0.96 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.824 0.345 . . . . 71.400000000000006 110.924 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.482 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -165.04 168.25 17.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 74.140000000000001 110.893 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -175.47 -36.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 73.400000000000006 110.868 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.0 -49.06 2.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 53.439999999999998 111.108 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.73 175.55 7.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 71.530000000000001 110.883 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.8 t -148.73 35.69 0.78 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 74.129999999999995 110.881 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -111.84 -75.96 0.6 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.182 -0.463 . . . . 54.200000000000003 110.909 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -77.82 60.41 2.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 65.019999999999996 110.827 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.5 p -84.34 156.97 21.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.453 . . . . 74.120000000000005 110.84 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.743 ' HB ' HD12 ' A' ' 35' ' ' LEU . 26.6 mm -142.96 141.07 27.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 74.120000000000005 111.15 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 12.7 mtt -144.63 142.68 30.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.206 -0.452 . . . . 73.230000000000004 110.876 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.6 m-20 -88.04 -174.85 4.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.429 . . . . 64.129999999999995 110.858 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -59.65 4.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 53.329999999999998 110.872 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.66 -58.64 5.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.317 -0.401 . . . . 74.319999999999993 110.889 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -49.62 -54.17 19.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.491 . . . . 70.329999999999998 110.89 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.1 p -55.71 -44.0 77.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.101 -0.499 . . . . 71.310000000000002 110.845 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.74 -43.45 80.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 72.140000000000001 110.839 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.1 -63.0 1.21 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.165 -0.47 . . . . 63.450000000000003 111.118 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.491 ' O ' HG13 ' A' ' 57' ' ' VAL . 14.5 t80 -51.86 -46.1 64.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 75.510000000000005 110.895 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.425 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.69 -49.93 71.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.129 -0.487 . . . . 72.25 110.894 179.913 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.21 -42.38 60.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 62.539999999999999 111.059 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.743 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -69.87 -66.97 0.52 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.444 . . . . 50.130000000000003 110.889 -179.885 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.9 m -47.31 -35.56 3.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 74.129999999999995 111.143 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -69.18 -54.34 15.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 73.219999999999999 110.973 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.67 -53.71 22.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 72.219999999999999 111.09 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.641 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -62.84 -48.14 80.35 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 72.140000000000001 110.881 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.65 -36.72 36.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 72.019999999999996 110.886 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.46 -53.62 10.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 75.129999999999995 111.07 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.23 -26.66 65.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 54.299999999999997 110.9 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 60' ' ' PHE . 17.2 m -96.14 -16.27 7.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.487 . . . . 72.400000000000006 111.094 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.17 -20.89 29.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 74.219999999999999 110.931 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.2 -21.1 31.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 75.049999999999997 111.155 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -51.57 -30.54 21.22 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.155 -0.475 . . . . 75.409999999999997 110.867 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' THR . . . . . 1.075 HG22 HG13 ' A' ' 69' ' ' VAL . 80.6 m -92.03 -77.84 0.42 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 74.540000000000006 111.132 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 1.075 HG13 HG22 ' A' ' 68' ' ' THR . 5.6 m -139.84 -178.36 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.204 -0.453 . . . . 73.319999999999993 111.103 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.4 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -101.21 154.88 36.92 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.575 0.702 . . . . 43.119999999999997 111.14 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.782 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.0 Cg_endo -69.77 -5.95 17.44 Favored 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.678 2.252 . . . . 72.519999999999996 112.332 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -93.67 -40.57 10.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.211 -0.45 . . . . 71.530000000000001 110.917 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.595 ' O ' HG23 ' A' ' 77' ' ' VAL . 19.6 t80 -57.06 -62.04 2.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 71.329999999999998 110.902 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.782 HD11 ' HA ' ' A' ' 71' ' ' PRO . 0.3 OUTLIER -39.8 -71.97 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 74.209999999999994 111.139 -179.981 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.402 HG23 ' N ' ' A' ' 76' ' ' LYS . 33.3 m -47.57 -38.73 6.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 71.120000000000005 111.142 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.402 ' N ' HG23 ' A' ' 75' ' ' VAL . 0.9 OUTLIER -62.82 -42.86 99.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 74.409999999999997 110.833 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.595 HG23 ' O ' ' A' ' 73' ' ' PHE . 25.3 t -62.78 -40.01 87.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 74.5 111.144 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.452 HH11 ' HD2' ' A' ' 78' ' ' ARG . 1.3 mtp85 -65.71 -55.03 19.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.444 . . . . 54.240000000000002 110.881 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.8 mmtp -66.48 -22.61 66.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 74.109999999999999 110.895 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -69.99 -52.98 19.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.464 . . . . 71.230000000000004 110.912 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.82 ' HB2' HD23 ' A' ' 83' ' ' LEU . 13.0 mt -89.84 13.63 14.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 64.349999999999994 110.908 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 53.65 38.7 28.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 54.039999999999999 110.831 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.82 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.6 mm? -78.73 81.75 5.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 70.209999999999994 110.919 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.562 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -44.57 156.79 0.07 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.214 -0.448 . . . . 63.520000000000003 111.122 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -54.18 -24.71 19.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.16 -0.473 . . . . 75.239999999999995 110.849 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.4 mtmt -79.14 -47.54 15.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.218 -0.446 . . . . 73.010000000000005 110.926 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.562 ' H ' HG23 ' A' ' 84' ' ' THR . 40.7 tt0 -65.28 -60.04 3.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.279 -0.419 . . . . 64.099999999999994 110.774 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.519 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -49.36 -34.92 17.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 73.150000000000006 111.085 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 84.9 p -77.78 -32.95 52.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 62.399999999999999 110.88 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -75.23 -29.98 60.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 63.229999999999997 110.882 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.735 HD12 ' CB ' ' A' ' 131' ' ' ARG . 17.8 mm -98.32 -63.08 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 61.130000000000003 111.1 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.562 ' HB3' HG23 ' A' ' 113' ' ' THR . 5.1 m-85 -73.11 -65.54 0.79 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.489 . . . . 75.430000000000007 110.896 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 125.21 32.6 0.78 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.719 -0.753 . . . . 44.310000000000002 112.459 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -51.92 -53.68 29.0 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.742 -0.742 . . . . 41.520000000000003 112.465 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 110.57 -136.23 13.44 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.687 -0.768 . . . . 71.530000000000001 112.506 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.24 -73.5 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.872 0.368 . . . . 62.219999999999999 111.127 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -85.64 42.66 0.98 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 71.140000000000001 110.889 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -59.7 -70.28 0.17 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.183 -0.462 . . . . 55.140000000000001 111.104 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -40.77 -48.78 3.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 75.239999999999995 110.88 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.7 m -55.13 -74.32 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 74.310000000000002 110.822 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.507 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 78.4 mtt180 -47.44 -55.17 9.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 64.230000000000004 110.865 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.651 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.0 m-85 -48.56 -36.57 15.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.178 -0.465 . . . . 64.349999999999994 110.917 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -57.1 -41.98 79.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.099 -0.5 . . . . 74.530000000000001 110.863 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.39 -15.66 30.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 61.219999999999999 110.868 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.42 25.64 23.01 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.735 -0.745 . . . . 73.049999999999997 112.519 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -93.68 -22.72 18.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 71.230000000000004 110.871 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.507 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -107.03 19.45 20.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.155 -0.475 . . . . 22.02 111.046 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.496 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.0 OUTLIER -121.23 53.42 3.57 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.652 0.739 . . . . 71.140000000000001 110.905 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.0 Cg_endo -69.8 28.49 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.683 2.256 . . . . 64.450000000000003 112.286 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.711 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.8 m-70 70.38 36.98 0.12 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.566 0.698 . . . . 74.340000000000003 110.838 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.711 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.7 Cg_endo -69.68 -165.27 0.15 Allowed 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.727 2.285 . . . . 74.129999999999995 112.369 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.7 p -82.04 -33.13 30.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.039 0.447 . . . . 63.140000000000001 110.88 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.587 HG22 ' CD1' ' A' ' 117' ' ' LEU . 23.0 m -49.25 -43.02 42.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.028 -0.533 . . . . 73.420000000000002 111.179 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.432 HD11 ' CG ' ' A' ' 108' ' ' GLN . 27.2 mm -60.82 -47.08 94.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 62.530000000000001 111.144 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.633 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -61.61 -27.7 68.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.145 -0.479 . . . . 73.219999999999999 110.942 179.901 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.633 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.4 mp -82.32 -45.64 14.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.203 -0.453 . . . . 74.040000000000006 110.848 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.78 HD13 HG22 ' A' ' 74' ' ' ILE . 14.5 mt -57.51 -46.89 83.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.44 . . . . 65.230000000000004 110.949 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.589 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.8 ptp180 -55.62 -35.08 65.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.488 . . . . 60.539999999999999 110.849 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.589 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.3 m -95.54 -5.37 10.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 73.219999999999999 111.157 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.742 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -88.84 -41.06 12.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.11 -0.496 . . . . 72.209999999999994 110.882 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -49.93 -31.82 13.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 72.409999999999997 110.876 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.11 -19.09 18.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 73.219999999999999 110.984 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.742 ' O ' HD13 ' A' ' 120' ' ' LEU . 47.7 m-70 -128.61 88.24 52.73 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.539 0.685 . . . . 61.530000000000001 110.83 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.581 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.7 Cg_endo -69.75 2.64 3.35 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.677 2.252 . . . . 63.340000000000003 112.357 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -115.73 -13.0 11.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.213 -0.448 . . . . 74.540000000000006 110.857 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.657 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.6 tp -54.49 -46.0 73.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.173 -0.467 . . . . 71.219999999999999 110.862 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.466 ' HB3' HD11 ' A' ' 120' ' ' LEU . 0.8 OUTLIER -49.18 -30.12 6.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 64.0 110.931 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.576 HD21 HH12 ' A' ' 131' ' ' ARG . 6.5 m120 -85.52 -29.93 23.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 73.409999999999997 110.935 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.422 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.0 OUTLIER -91.23 4.61 51.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 71.439999999999998 110.822 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.657 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.3 pt -124.06 -34.94 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.202 -0.453 . . . . 75.140000000000001 111.138 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.735 ' CB ' HD12 ' A' ' 91' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 65.420000000000002 110.84 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mtt . . . . . 0 C--O 1.23 0.043 0 CA-C-O 120.837 0.351 . . . . 71.030000000000001 110.927 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.4 -169.33 0.44 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 75.439999999999998 110.941 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.445 ' O ' ' N ' ' A' ' 7' ' ' HIS . 0.1 OUTLIER 174.88 57.99 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.569 0.7 . . . . 43.340000000000003 110.938 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.75 -0.59 7.13 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.649 2.232 . . . . 71.420000000000002 112.353 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.479 HG21 ' CD ' ' A' ' 42' ' ' GLU . 29.5 m -90.01 -44.33 14.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.435 . . . . 73.209999999999994 111.119 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.457 ' N ' HG23 ' A' ' 5' ' ' VAL . 14.2 p -119.51 -27.65 5.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 61.32 110.88 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.445 ' N ' ' O ' ' A' ' 3' ' ' CYS . 43.6 m-70 62.63 53.67 2.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 72.329999999999998 110.868 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -119.41 -75.16 0.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 75.219999999999999 110.956 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -98.87 -133.72 8.18 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.668 -0.777 . . . . 52.109999999999999 112.51 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.478 ' O ' HG12 ' A' ' 12' ' ' VAL . 6.1 pt-20 -156.06 87.41 1.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.863 0.363 . . . . 70.420000000000002 110.926 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.556 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -48.69 105.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 75.519999999999996 110.826 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.478 HG12 ' O ' ' A' ' 10' ' ' GLU . 4.2 p -141.85 126.48 16.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 64.129999999999995 111.163 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.587 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.3 p -49.27 131.71 19.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 73.310000000000002 110.908 -179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.411 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 177.98 80.66 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.805 -0.712 . . . . 74.040000000000006 112.481 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.411 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -37.08 146.9 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.882 0.372 . . . . 74.439999999999998 111.106 -179.985 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.24 -165.1 1.51 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 73.340000000000003 110.9 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.64 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -95.64 117.21 30.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.268 -0.424 . . . . 75.120000000000005 110.89 179.857 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.727 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.2 mm -107.79 91.23 7.22 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.62 0.724 . . . . 71.030000000000001 111.124 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 96.15 0.58 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.685 2.257 . . . . 61.100000000000001 112.364 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.549 ' HB3' HG23 ' A' ' 27' ' ' THR . 6.5 t80 -60.96 -35.83 77.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 63.409999999999997 110.934 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.435 HG21 ' HG2' ' A' ' 25' ' ' ARG . 6.4 m -132.37 144.38 50.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 61.119999999999997 111.187 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -133.58 45.77 2.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 73.400000000000006 110.915 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.416 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -132.45 -68.46 0.61 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.085 -0.507 . . . . 71.450000000000003 110.832 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.52 -47.31 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.749 -0.739 . . . . 64.209999999999994 112.529 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.435 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.24 40.8 1.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.797 0.332 . . . . 74.319999999999993 110.856 -179.893 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.2 tttm -53.92 117.64 3.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.189 -0.46 . . . . 73.319999999999993 110.92 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.549 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -130.07 92.85 3.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 73.420000000000002 111.134 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.64 HG11 ' HB2' ' A' ' 17' ' ' ASP . 40.7 t -77.31 125.88 37.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 73.310000000000002 111.115 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.734 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.84 51.55 2.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 62.310000000000002 110.889 179.979 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.9 mttm -37.94 108.06 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 71.219999999999999 110.923 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.66 47.08 0.42 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.738 -0.744 . . . . 72.209999999999994 112.527 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.581 HD11 ' HB3' ' A' ' 29' ' ' LEU . 14.8 mm -107.99 90.95 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.856 0.36 . . . . 61.5 111.113 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.89 154.14 39.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 61.350000000000001 110.839 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 168.25 -109.37 0.34 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.716 -0.754 . . . . 52.539999999999999 112.478 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.749 HD12 ' HB ' ' A' ' 44' ' ' ILE . 58.4 mt -156.89 86.86 0.98 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.815 0.34 . . . . 71.400000000000006 110.894 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -159.44 160.19 34.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 74.140000000000001 110.963 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 32.2 t -171.85 -39.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.162 -0.472 . . . . 73.400000000000006 110.918 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.409 HG13 ' N ' ' A' ' 39' ' ' HIS . 2.6 p -123.26 -46.6 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.121 -0.49 . . . . 53.439999999999998 111.045 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.409 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -91.82 171.03 9.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.23 -0.441 . . . . 71.530000000000001 110.846 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.84 19.8 2.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 74.129999999999995 110.892 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -110.27 -63.13 1.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.255 -0.43 . . . . 54.200000000000003 110.876 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.479 ' CD ' HG21 ' A' ' 5' ' ' VAL . 13.1 tp10 -76.87 61.94 2.0 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.124 -0.489 . . . . 65.019999999999996 110.914 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.7 p -95.42 154.81 17.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.078 -0.51 . . . . 74.120000000000005 110.846 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.749 ' HB ' HD12 ' A' ' 35' ' ' LEU . 18.2 mm -142.41 139.48 29.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 74.120000000000005 111.135 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.6 mtt -141.62 145.22 34.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 73.230000000000004 110.901 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.0 m-20 -90.55 -170.51 2.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 64.129999999999995 110.873 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.24 -61.08 2.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 53.329999999999998 110.853 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -51.49 -57.43 9.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 74.319999999999993 110.878 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.29 -58.67 5.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 70.329999999999998 110.875 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.7 t -52.18 -43.94 64.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 71.310000000000002 110.873 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.92 -44.02 81.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.119 -0.491 . . . . 72.140000000000001 110.895 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.46 -63.19 1.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 63.450000000000003 111.045 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.482 ' O ' HG13 ' A' ' 57' ' ' VAL . 14.4 t80 -51.63 -47.42 63.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.288 -0.414 . . . . 75.510000000000005 110.927 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.427 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.37 -49.37 75.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 72.25 110.844 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.52 -43.11 62.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.258 -0.428 . . . . 62.539999999999999 111.153 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.734 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -69.28 -66.73 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 50.130000000000003 110.875 -179.861 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.482 HG13 ' O ' ' A' ' 53' ' ' PHE . 11.4 m -47.27 -37.02 4.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.277 -0.42 . . . . 74.129999999999995 111.058 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -67.17 -54.79 17.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 73.219999999999999 110.829 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.32 -52.32 28.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.441 . . . . 72.219999999999999 111.084 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.718 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -64.83 -50.08 68.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.281 -0.418 . . . . 72.140000000000001 110.818 -179.912 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.41 -34.99 26.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 72.019999999999996 110.881 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.26 -56.19 5.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 75.129999999999995 111.066 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.89 -32.21 52.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 54.299999999999997 110.81 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.718 HG22 ' O ' ' A' ' 60' ' ' PHE . 34.3 m -89.03 -24.79 5.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.165 -0.47 . . . . 72.400000000000006 111.131 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.87 -20.03 14.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.169 -0.469 . . . . 74.219999999999999 110.877 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -48.35 -34.3 10.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 75.049999999999997 111.107 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.09 -55.77 15.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.235 -0.438 . . . . 75.409999999999997 110.836 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.744 HG22 HG13 ' A' ' 69' ' ' VAL . 96.8 m -163.51 -78.66 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 74.540000000000006 111.148 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.744 HG13 HG22 ' A' ' 68' ' ' THR . 16.0 m -148.93 -173.66 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.151 -0.477 . . . . 73.319999999999993 111.159 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.567 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.2 160.15 27.21 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.535 0.683 . . . . 43.119999999999997 111.079 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.567 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.7 Cg_endo -69.79 -8.2 22.99 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.634 2.222 . . . . 72.519999999999996 112.324 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.41 -37.46 10.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 71.530000000000001 110.924 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -55.94 -59.42 4.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 71.329999999999998 110.835 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.748 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -46.27 -69.32 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.18 -0.464 . . . . 74.209999999999994 111.139 -179.973 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.3 m -47.54 -38.02 5.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 71.120000000000005 111.145 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -61.59 -45.2 95.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.485 . . . . 74.409999999999997 110.916 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.648 HG22 ' HB2' ' A' ' 121' ' ' ASP . 72.6 t -63.03 -38.92 83.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.444 . . . . 74.5 111.134 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.483 HH22 HG21 ' A' ' 113' ' ' THR . 0.1 OUTLIER -64.23 -54.79 27.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 54.240000000000002 110.892 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.99 -21.61 64.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 74.109999999999999 110.909 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -70.11 -53.69 16.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 71.230000000000004 110.896 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.824 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.6 mt -90.89 13.88 15.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 64.349999999999994 110.896 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 52.64 38.64 26.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 54.039999999999999 110.819 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.824 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.8 mm? -79.01 86.48 4.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.137 -0.483 . . . . 70.209999999999994 110.909 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.651 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.82 156.74 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 63.520000000000003 111.175 179.951 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -56.88 -22.07 34.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 75.239999999999995 110.937 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.63 -52.42 7.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 73.010000000000005 110.903 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.651 ' H ' HG23 ' A' ' 84' ' ' THR . 4.1 tp10 -58.93 -55.38 35.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 64.099999999999994 110.919 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.449 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -50.85 -31.64 17.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.49 . . . . 73.150000000000006 111.067 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 7.5 p -80.97 -32.13 34.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.435 . . . . 62.399999999999999 110.899 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.77 -21.82 54.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.075 -0.511 . . . . 63.229999999999997 110.887 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.751 HD12 ' HB3' ' A' ' 131' ' ' ARG . 22.4 mm -107.37 -61.71 2.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.47 . . . . 61.130000000000003 111.082 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.566 ' HB3' HG23 ' A' ' 113' ' ' THR . 4.5 m-85 -75.91 -64.04 1.17 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 75.430000000000007 110.852 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 116.49 49.21 0.44 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.763 -0.732 . . . . 44.310000000000002 112.443 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -72.03 -36.72 60.58 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.743 -0.741 . . . . 41.520000000000003 112.516 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.03 -123.52 7.15 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.727 -0.749 . . . . 71.530000000000001 112.474 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.489 HG22 ' N ' ' A' ' 97' ' ' ASN . 0.1 OUTLIER -120.46 -62.03 2.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 62.219999999999999 111.1 -179.986 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.489 ' N ' HG22 ' A' ' 96' ' ' VAL . 12.8 p30 -85.61 39.94 0.82 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 71.140000000000001 110.914 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.425 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -60.74 -77.54 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 55.140000000000001 111.068 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.425 ' C ' ' O ' ' A' ' 98' ' ' ALA . 54.7 m-85 -35.91 -46.74 0.48 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 75.239999999999995 110.884 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -57.35 -76.4 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 74.310000000000002 110.865 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.53 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 8.9 mtt180 -47.92 -52.73 18.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 64.230000000000004 110.865 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.632 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.6 m-85 -49.04 -38.62 24.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 64.349999999999994 110.949 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -52.79 -41.33 64.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.087 -0.506 . . . . 74.530000000000001 110.854 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.79 -17.24 24.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 61.219999999999999 110.977 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 94.08 25.51 16.78 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.757 -0.735 . . . . 73.049999999999997 112.505 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -92.89 -23.37 18.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.882 0.373 . . . . 71.230000000000004 110.938 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.53 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -103.86 17.22 24.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 22.02 111.079 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.499 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -120.3 55.02 3.72 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.605 0.717 . . . . 71.140000000000001 110.98 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 54.1 Cg_endo -69.66 27.6 0.17 Allowed 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.633 2.222 . . . . 64.450000000000003 112.396 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.718 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.8 m-70 70.34 37.17 0.13 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.595 0.712 . . . . 74.340000000000003 110.869 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.718 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.5 Cg_endo -69.75 -165.25 0.15 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.67 2.247 . . . . 74.129999999999995 112.306 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 31.8 m -83.27 -33.44 26.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 63.140000000000001 110.818 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.566 HG23 ' HB3' ' A' ' 92' ' ' PHE . 23.9 m -49.09 -41.66 36.35 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.116 -0.493 . . . . 73.420000000000002 111.141 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.535 HG21 ' CG2' ' A' ' 68' ' ' THR . 25.1 mm -60.6 -44.16 96.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.266 -0.425 . . . . 62.530000000000001 111.1 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.635 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -64.28 -29.18 70.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 73.219999999999999 110.927 179.87 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.635 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.4 mp -81.23 -43.24 19.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 74.040000000000006 110.937 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.748 HD13 HG22 ' A' ' 74' ' ' ILE . 18.5 mt -60.5 -49.06 79.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.228 -0.442 . . . . 65.230000000000004 110.939 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.565 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.2 ptp180 -52.86 -38.52 61.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 60.539999999999999 110.843 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.565 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.4 m -89.86 -11.08 10.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 73.219999999999999 111.094 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.768 HD12 HD13 ' A' ' 81' ' ' LEU . 0.5 OUTLIER -81.6 -39.87 23.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.206 -0.452 . . . . 72.209999999999994 110.925 179.927 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.648 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.4 OUTLIER -50.85 -30.38 14.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 72.409999999999997 110.832 179.9 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -98.3 -18.3 18.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 73.219999999999999 110.956 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.752 ' O ' HD13 ' A' ' 120' ' ' LEU . 59.7 m-70 -130.56 88.69 46.15 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.615 0.721 . . . . 61.530000000000001 110.879 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.695 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.2 Cg_endo -69.77 2.61 3.38 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.707 2.272 . . . . 63.340000000000003 112.367 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -116.44 -12.22 11.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 74.540000000000006 110.859 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.657 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.5 tp -54.22 -46.64 72.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 71.219999999999999 110.862 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.486 HD13 HD11 ' A' ' 83' ' ' LEU . 1.3 pt? -49.36 -29.59 6.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 64.0 110.901 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.49 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 6.5 m120 -86.16 -29.29 23.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.224 -0.444 . . . . 73.409999999999997 110.864 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.426 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -92.29 4.68 52.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 71.439999999999998 110.946 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.657 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.1 pt -124.04 -34.95 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.099 -0.501 . . . . 75.140000000000001 111.143 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.751 ' HB3' HD12 ' A' ' 91' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 65.420000000000002 110.899 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mmt . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.818 0.342 . . . . 71.030000000000001 110.822 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.78 -170.73 0.5 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 75.439999999999998 110.859 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 1.7 p 178.05 56.22 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.53 0.681 . . . . 43.340000000000003 110.794 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.405 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 55.2 Cg_endo -69.72 -8.83 24.6 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.699 2.266 . . . . 71.420000000000002 112.37 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.67 HG21 ' CD ' ' A' ' 42' ' ' GLU . 6.0 m -67.21 -49.98 67.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 73.209999999999994 111.115 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.464 ' N ' HG23 ' A' ' 5' ' ' VAL . 1.2 m -133.2 -21.1 2.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.093 -0.503 . . . . 61.32 110.845 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 66.91 88.96 0.1 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.253 -0.431 . . . . 72.329999999999998 110.87 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.428 ' NE2' ' HB3' ' A' ' 6' ' ' CYS . 14.1 mp0 -132.34 -66.57 0.69 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.249 -0.432 . . . . 75.219999999999999 110.933 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -127.37 -92.9 0.8 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.814 -0.707 . . . . 52.109999999999999 112.529 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 178.34 91.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.838 0.351 . . . . 70.420000000000002 110.845 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.57 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.0 OUTLIER -57.23 99.65 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 75.519999999999996 110.865 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -139.7 128.95 28.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 64.129999999999995 111.152 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.619 ' N ' HD23 ' A' ' 35' ' ' LEU . 42.3 m -48.87 130.44 18.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.182 -0.463 . . . . 73.310000000000002 110.852 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.404 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 177.49 82.13 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.658 -0.782 . . . . 74.040000000000006 112.471 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.428 HD12 ' N ' ' A' ' 15' ' ' ILE . 0.7 OUTLIER -37.59 147.17 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.881 0.372 . . . . 74.439999999999998 111.118 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.56 -168.61 2.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.454 . . . . 73.340000000000003 110.886 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.712 ' HB3' HG21 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -95.02 113.6 25.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 75.120000000000005 110.868 179.874 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.758 ' O ' HD22 ' A' ' 29' ' ' LEU . 5.7 mm -106.67 88.5 3.5 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.609 0.719 . . . . 71.030000000000001 111.125 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.526 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 54.1 Cg_endo -69.75 99.52 0.75 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.699 2.266 . . . . 61.100000000000001 112.374 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -65.07 -32.47 74.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.279 -0.419 . . . . 63.409999999999997 110.917 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.544 HG21 ' HG2' ' A' ' 25' ' ' ARG . 23.5 m -130.68 147.83 52.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.129 -0.487 . . . . 61.119999999999997 111.098 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -147.7 35.14 0.85 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 73.400000000000006 110.864 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.424 ' HD3' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -122.48 -43.0 2.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 71.450000000000003 110.926 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -154.56 -52.96 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.741 -0.742 . . . . 64.209999999999994 112.504 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.544 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -96.51 44.77 1.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.856 0.36 . . . . 74.319999999999993 110.886 -179.86 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.427 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 9.9 tttm -50.11 118.39 2.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 73.319999999999993 110.903 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.403 ' O ' HG23 ' A' ' 27' ' ' THR . 2.0 t -136.46 82.88 1.97 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 73.420000000000002 111.157 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.712 HG21 ' HB3' ' A' ' 17' ' ' ASP . 1.7 p -73.96 133.82 30.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.201 -0.454 . . . . 73.310000000000002 111.186 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.781 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.2 OUTLIER -84.41 53.73 2.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 62.310000000000002 110.894 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.403 ' C ' ' O ' ' A' ' 29' ' ' LEU . 13.8 mttm -37.07 105.88 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 71.219999999999999 110.895 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.47 50.8 0.36 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.736 -0.745 . . . . 72.209999999999994 112.527 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.647 HD11 ' CB ' ' A' ' 29' ' ' LEU . 22.9 mm -107.36 96.53 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.817 0.341 . . . . 61.5 111.115 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -77.57 153.26 33.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 61.350000000000001 110.825 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.19 -108.43 0.31 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.745 -0.74 . . . . 52.539999999999999 112.545 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.734 HD12 ' HB ' ' A' ' 44' ' ' ILE . 48.4 mt -156.88 85.8 0.97 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.858 0.361 . . . . 71.400000000000006 110.892 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.534 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -162.3 164.54 27.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 74.140000000000001 110.95 179.956 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 43.0 t -168.31 -38.76 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.145 -0.48 . . . . 73.400000000000006 110.9 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.1 m -128.44 -45.63 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 53.439999999999998 111.18 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.02 169.28 11.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 71.530000000000001 110.889 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 10.6 p -134.93 7.38 3.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.223 -0.444 . . . . 74.129999999999995 110.849 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -94.55 -65.02 1.01 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 54.200000000000003 110.921 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.67 ' CD ' HG21 ' A' ' 5' ' ' VAL . 13.4 tp10 -76.49 61.56 1.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.101 -0.5 . . . . 65.019999999999996 110.885 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.3 p -99.92 158.31 15.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.091 -0.504 . . . . 74.120000000000005 110.887 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.734 ' HB ' HD12 ' A' ' 35' ' ' LEU . 23.9 mm -142.37 140.18 29.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.491 . . . . 74.120000000000005 111.139 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.3 mtm -145.14 132.04 20.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 73.230000000000004 110.837 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 -84.91 -170.42 3.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.443 . . . . 64.129999999999995 110.845 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -55.22 32.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 53.329999999999998 110.985 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.38 -55.57 33.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.181 -0.463 . . . . 74.319999999999993 110.836 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -52.29 -60.83 2.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 70.329999999999998 110.892 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.7 t -54.71 -38.03 66.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 71.310000000000002 110.876 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -59.15 -45.7 90.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.126 -0.488 . . . . 72.140000000000001 110.869 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.48 -57.94 7.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 63.450000000000003 111.057 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.49 ' O ' HG13 ' A' ' 57' ' ' VAL . 14.1 t80 -54.16 -46.99 72.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 75.510000000000005 110.92 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.425 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -64.57 -50.27 67.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.14 -0.482 . . . . 72.25 110.879 179.976 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.22 -40.64 59.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 62.539999999999999 111.066 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.781 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -71.02 -67.51 0.5 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.452 . . . . 50.130000000000003 110.921 -179.924 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.556 HG12 HD21 ' A' ' 29' ' ' LEU . 12.4 m -47.24 -35.19 3.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.179 -0.464 . . . . 74.129999999999995 111.15 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -70.97 -51.26 26.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 73.219999999999999 110.897 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.77 -49.43 62.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.263 -0.426 . . . . 72.219999999999999 111.124 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.65 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.4 OUTLIER -67.0 -48.09 69.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 72.140000000000001 110.808 -179.913 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.12 -50.12 49.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 72.019999999999996 110.899 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.62 -54.37 32.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 75.129999999999995 111.066 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.87 -38.81 37.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 54.299999999999997 110.881 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 60' ' ' PHE . 37.2 t -81.86 -25.47 9.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 72.400000000000006 111.104 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.411 ' HB2' ' HA ' ' A' ' 109' ' ' PRO . 0.0 OUTLIER -64.14 -21.61 66.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 74.219999999999999 110.852 -179.986 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.46 4.1 33.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 75.049999999999997 111.176 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -104.62 -28.26 11.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 75.409999999999997 110.883 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.904 HG22 HG13 ' A' ' 69' ' ' VAL . 61.2 m -50.52 -72.64 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.119 -0.491 . . . . 74.540000000000006 111.131 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.904 HG13 HG22 ' A' ' 68' ' ' THR . 11.5 m -138.08 -174.58 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.234 -0.439 . . . . 73.319999999999993 111.135 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.547 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -105.41 159.86 28.02 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.624 0.726 . . . . 43.119999999999997 111.101 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.594 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.8 Cg_endo -69.75 -7.14 20.31 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.678 2.252 . . . . 72.519999999999996 112.379 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.98 -37.98 11.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.219 -0.446 . . . . 71.530000000000001 110.892 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -57.51 -61.61 2.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 71.329999999999998 110.879 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.8 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.87 -67.32 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 74.209999999999994 111.099 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.0 m -49.3 -39.12 12.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 71.120000000000005 111.099 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -60.88 -45.72 93.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 74.409999999999997 110.898 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.538 HG22 ' HB2' ' A' ' 121' ' ' ASP . 76.7 t -61.33 -39.12 81.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 74.5 111.167 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.54 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -64.08 -59.34 4.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 54.240000000000002 110.915 179.993 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -22.72 67.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 74.109999999999999 110.926 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -69.21 -53.13 21.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 71.230000000000004 110.905 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.806 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.6 mt -90.69 12.95 17.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 64.349999999999994 110.931 179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 54.54 37.51 28.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.429 . . . . 54.039999999999999 110.871 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.806 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.8 mm? -80.02 87.11 5.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.109 -0.496 . . . . 70.209999999999994 110.899 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.648 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.77 157.17 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 63.520000000000003 111.142 179.961 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -57.6 -21.33 38.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 75.239999999999995 110.948 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.0 mmtp -81.3 -49.89 10.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.442 . . . . 73.010000000000005 110.914 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.648 ' H ' HG23 ' A' ' 84' ' ' THR . 7.2 tp10 -62.31 -52.36 63.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.436 . . . . 64.099999999999994 110.913 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.76 -36.49 67.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 73.150000000000006 111.084 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 30.6 t -79.18 -26.34 42.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 62.399999999999999 110.856 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -81.15 -27.69 35.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 63.229999999999997 110.883 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.732 HD12 ' HB3' ' A' ' 131' ' ' ARG . 26.5 mm -101.11 -59.09 3.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.116 -0.493 . . . . 61.130000000000003 111.172 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.596 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.7 m-85 -75.7 -61.29 1.97 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 75.430000000000007 110.878 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.32 48.98 0.78 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.754 -0.736 . . . . 44.310000000000002 112.471 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.61 -38.91 31.12 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.737 -0.744 . . . . 41.520000000000003 112.499 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 106.98 165.56 22.28 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.749 -0.738 . . . . 71.530000000000001 112.52 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.5 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.8 p -51.4 -51.39 24.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.896 0.379 . . . . 62.219999999999999 111.135 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.5 ' N ' HG13 ' A' ' 96' ' ' VAL . 9.0 t30 -87.24 39.17 0.85 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 71.140000000000001 110.866 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.7 -76.28 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 55.140000000000001 111.108 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -43.41 -39.72 3.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.439 . . . . 75.239999999999995 110.91 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 38.9 t -59.95 -75.57 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 74.310000000000002 110.818 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.624 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 36.2 mtt180 -50.61 -45.21 57.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 64.230000000000004 110.829 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.723 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.4 m-85 -56.25 -36.67 68.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.268 -0.423 . . . . 64.349999999999994 110.932 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -52.13 -28.99 19.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.122 -0.49 . . . . 74.530000000000001 110.854 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.77 -22.63 12.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.203 -0.453 . . . . 61.219999999999999 110.862 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.92 27.19 9.07 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.772 -0.727 . . . . 73.049999999999997 112.498 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -98.13 -6.62 31.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.791 0.329 . . . . 71.230000000000004 110.879 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.624 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -110.33 10.15 23.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 22.02 111.126 179.808 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.577 ' HB2' HD11 ' A' ' 114' ' ' ILE . 2.0 pt20 -125.14 57.27 15.79 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.598 0.714 . . . . 71.140000000000001 110.947 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.533 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.2 Cg_endo -69.82 36.68 0.24 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.671 2.247 . . . . 64.450000000000003 112.341 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.775 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.7 OUTLIER 73.9 32.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.554 0.693 . . . . 74.340000000000003 110.835 179.918 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.775 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.6 Cg_endo -69.74 -163.99 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.764 2.31 . . . . 74.129999999999995 112.322 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.4 p -86.65 -29.4 22.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.435 . . . . 63.140000000000001 110.84 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.599 HG22 HD12 ' A' ' 117' ' ' LEU . 34.5 m -53.41 -50.76 64.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.089 -0.505 . . . . 73.420000000000002 111.112 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.577 HD11 ' HB2' ' A' ' 108' ' ' GLN . 43.3 mm -51.34 -42.5 27.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.264 -0.425 . . . . 62.530000000000001 111.136 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.541 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -67.98 -29.86 69.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.225 -0.443 . . . . 73.219999999999999 110.868 179.838 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.541 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.7 mp -79.11 -41.64 28.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.277 -0.42 . . . . 74.040000000000006 110.886 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.8 HD13 HG22 ' A' ' 74' ' ' ILE . 14.8 mt -64.32 -49.27 72.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.149 -0.478 . . . . 65.230000000000004 110.962 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.595 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.3 ptp180 -51.92 -34.94 43.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 60.539999999999999 110.886 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.595 HG13 ' HG3' ' A' ' 118' ' ' ARG . 29.5 m -93.57 -14.74 8.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 73.219999999999999 111.194 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.769 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -76.05 -39.33 55.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 72.209999999999994 110.966 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.538 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.9 OUTLIER -50.67 -30.52 13.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.227 -0.442 . . . . 72.409999999999997 110.859 179.793 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -96.72 -20.01 18.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 73.219999999999999 110.886 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.769 ' O ' HD13 ' A' ' 120' ' ' LEU . 65.6 m-70 -131.21 90.05 39.76 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 121.619 0.723 . . . . 61.530000000000001 110.881 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.725 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.0 Cg_endo -69.69 -0.07 6.32 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.758 2.305 . . . . 63.340000000000003 112.345 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -113.48 -11.92 13.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.216 -0.447 . . . . 74.540000000000006 110.902 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.683 ' O ' HG23 ' A' ' 130' ' ' ILE . 6.3 tp -53.81 -47.78 70.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.149 -0.478 . . . . 71.219999999999999 110.845 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.739 HD13 HD11 ' A' ' 83' ' ' LEU . 2.1 pt? -51.1 -28.95 11.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 64.0 110.934 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.492 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.73 -26.05 24.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 73.409999999999997 110.869 179.929 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.411 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.0 OUTLIER -96.02 3.52 53.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 71.439999999999998 110.86 -179.978 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.683 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.7 pt -122.41 -34.49 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 75.140000000000001 111.207 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.732 ' HB3' HD12 ' A' ' 91' ' ' ILE . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 65.420000000000002 110.875 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.543 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 3.1 mmt . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.843 0.354 . . . . 71.030000000000001 110.919 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.7 -169.61 0.43 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.429 . . . . 75.439999999999998 110.903 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 p 176.92 57.84 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.677 0.751 . . . . 43.340000000000003 110.872 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 3.71 2.62 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.679 2.253 . . . . 71.420000000000002 112.332 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.2 m -95.66 -42.46 12.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 73.209999999999994 111.143 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.38 -32.69 3.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.15 -0.477 . . . . 61.32 110.831 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 65.35 51.02 1.64 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 72.329999999999998 110.851 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 94.8 mm-40 -114.59 -75.42 0.59 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 75.219999999999999 110.9 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -99.18 -112.43 3.3 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.79 -0.719 . . . . 52.109999999999999 112.526 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.543 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 8.0 pt-20 -175.81 97.12 0.07 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.81 0.338 . . . . 70.420000000000002 110.92 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.566 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.4 ptp -55.64 106.14 0.23 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 75.519999999999996 110.895 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.3 p -148.63 129.61 5.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.218 -0.446 . . . . 64.129999999999995 111.16 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.53 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -45.3 125.21 5.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 73.310000000000002 110.844 -179.84 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.9 82.17 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.759 -0.734 . . . . 74.040000000000006 112.488 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.407 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -38.34 148.87 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.864 0.364 . . . . 74.439999999999998 111.133 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.47 -164.74 1.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 73.340000000000003 110.9 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.657 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -97.4 116.66 30.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.211 -0.449 . . . . 75.120000000000005 110.871 179.86 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.722 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.4 mm -107.56 91.78 7.65 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.607 0.718 . . . . 71.030000000000001 111.158 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.422 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.6 Cg_endo -69.7 95.81 0.56 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.751 2.301 . . . . 61.100000000000001 112.379 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.504 ' HB3' HG23 ' A' ' 27' ' ' THR . 15.5 t80 -60.18 -40.39 89.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.0 0.428 . . . . 63.409999999999997 110.875 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.457 HG21 ' HG2' ' A' ' 25' ' ' ARG . 14.6 m -127.83 145.23 51.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 61.119999999999997 111.159 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -134.25 45.09 2.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 73.400000000000006 110.872 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.447 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -131.99 -68.44 0.63 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 71.450000000000003 110.865 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.35 -47.0 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.798 -0.715 . . . . 64.209999999999994 112.541 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.457 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.15 39.83 1.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.813 0.34 . . . . 74.319999999999993 110.852 -179.867 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.8 tttm -52.96 117.92 3.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 73.319999999999993 110.904 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.504 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.8 t -131.41 93.98 3.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 73.420000000000002 111.139 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.657 HG11 ' HB2' ' A' ' 17' ' ' ASP . 42.0 t -77.78 126.05 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.441 . . . . 73.310000000000002 111.147 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.722 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.3 OUTLIER -84.28 52.42 2.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.153 -0.476 . . . . 62.310000000000002 110.966 -179.989 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -39.19 106.92 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 71.219999999999999 110.901 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.88 45.6 0.37 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.698 -0.763 . . . . 72.209999999999994 112.437 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.57 HD11 ' HB3' ' A' ' 29' ' ' LEU . 14.3 mm -106.66 90.35 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.829 0.347 . . . . 61.5 111.118 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.54 158.57 34.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 61.350000000000001 110.888 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 164.42 -106.58 0.28 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.782 -0.723 . . . . 52.539999999999999 112.513 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.759 HD12 ' HB ' ' A' ' 44' ' ' ILE . 47.7 mt -156.63 82.65 0.96 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.839 0.352 . . . . 71.400000000000006 110.926 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.474 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -165.66 169.03 15.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.454 . . . . 74.140000000000001 110.932 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -176.6 -35.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 73.400000000000006 110.927 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -123.52 -45.94 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 53.439999999999998 111.071 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -95.33 176.44 6.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.128 -0.487 . . . . 71.530000000000001 110.844 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.4 p -148.54 30.71 0.82 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.19 -0.459 . . . . 74.129999999999995 110.885 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -105.14 -76.32 0.61 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 54.200000000000003 110.9 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -78.28 60.27 2.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 65.019999999999996 110.869 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.2 p -84.23 157.82 21.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 74.120000000000005 110.879 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.759 ' HB ' HD12 ' A' ' 35' ' ' LEU . 24.8 mm -143.81 140.91 25.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 74.120000000000005 111.139 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.7 mtt -143.8 145.43 32.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.066 -0.516 . . . . 73.230000000000004 110.857 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 41.7 m-20 -91.52 -169.97 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 64.129999999999995 110.83 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.69 -60.73 3.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 53.329999999999998 110.892 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -51.19 -57.41 8.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 74.319999999999993 110.908 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.02 -57.92 7.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.11 -0.496 . . . . 70.329999999999998 110.915 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.0 t -53.46 -42.17 66.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.124 -0.489 . . . . 71.310000000000002 110.853 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -57.6 -44.67 85.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 72.140000000000001 110.878 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.76 -61.51 2.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 63.450000000000003 111.155 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.494 ' O ' HG13 ' A' ' 57' ' ' VAL . 15.3 t80 -52.32 -47.29 66.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 75.510000000000005 110.848 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.426 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.2 -49.6 73.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 72.25 110.835 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.44 -42.27 61.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.256 -0.429 . . . . 62.539999999999999 111.127 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.717 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -69.96 -66.67 0.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 50.130000000000003 110.886 -179.886 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.494 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.0 m -47.45 -35.63 4.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.434 . . . . 74.129999999999995 111.167 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -69.04 -54.58 14.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 73.219999999999999 110.857 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.7 -54.35 19.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 72.219999999999999 111.105 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.551 ' O ' HG13 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -61.79 -48.91 78.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 72.140000000000001 110.928 -179.941 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.47 -39.44 33.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 72.019999999999996 110.839 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.52 -54.33 12.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 75.129999999999995 111.096 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.24 -31.39 63.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 54.299999999999997 110.826 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.551 HG13 ' O ' ' A' ' 60' ' ' PHE . 11.2 m -88.18 -22.51 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 72.400000000000006 111.175 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -51.68 -26.27 8.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 74.219999999999999 110.859 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -75.65 -38.01 59.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 75.049999999999997 111.094 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 49.78 -168.21 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 75.409999999999997 110.807 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 54.9 m -155.72 -77.03 0.1 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.055 -0.521 . . . . 74.540000000000006 111.127 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.444 HG21 HG23 ' A' ' 114' ' ' ILE . 0.9 OUTLIER -151.17 144.66 16.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 73.319999999999993 111.091 179.974 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.414 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -78.99 155.63 77.43 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.621 0.724 . . . . 43.119999999999997 111.107 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.648 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.9 Cg_endo -69.62 -6.93 19.72 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.736 2.29 . . . . 72.519999999999996 112.347 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.17 -36.69 9.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 71.530000000000001 110.917 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.583 ' O ' HG23 ' A' ' 77' ' ' VAL . 21.7 t80 -59.06 -61.72 2.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.495 . . . . 71.329999999999998 110.856 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.844 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -39.43 -69.62 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 74.209999999999994 111.134 179.937 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.418 HG23 ' N ' ' A' ' 76' ' ' LYS . 35.7 m -49.54 -40.01 14.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.093 -0.503 . . . . 71.120000000000005 111.168 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.418 ' N ' HG23 ' A' ' 75' ' ' VAL . 25.2 mtmt -60.92 -45.12 95.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 74.409999999999997 110.933 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 73' ' ' PHE . 21.9 t -60.83 -39.79 83.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.146 -0.479 . . . . 74.5 111.086 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.464 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -63.98 -59.55 4.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 54.240000000000002 110.909 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt -63.05 -22.85 67.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 74.109999999999999 110.895 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -68.92 -52.95 24.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 71.230000000000004 110.84 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.693 HD22 ' HB3' ' A' ' 124' ' ' PRO . 11.7 mt -91.12 13.1 17.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.245 -0.434 . . . . 64.349999999999994 110.906 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.2 m 55.35 38.34 30.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.447 . . . . 54.039999999999999 110.837 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.686 HD21 HD13 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -79.54 86.67 5.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 70.209999999999994 110.92 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.637 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.53 157.23 0.15 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.482 . . . . 63.520000000000003 111.124 179.937 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -56.26 -21.74 25.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 75.239999999999995 110.911 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -81.97 -48.85 10.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.206 -0.452 . . . . 73.010000000000005 110.959 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.637 ' H ' HG23 ' A' ' 84' ' ' THR . 5.5 tp10 -61.89 -56.88 14.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 64.099999999999994 110.886 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.405 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -51.78 -38.04 53.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.169 -0.469 . . . . 73.150000000000006 111.099 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 27.0 t -77.69 -26.75 50.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 62.399999999999999 110.797 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -80.85 -29.21 35.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 63.229999999999997 110.868 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.768 HD12 ' HB3' ' A' ' 131' ' ' ARG . 18.2 mm -99.8 -60.95 2.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 61.130000000000003 111.106 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.608 ' HB3' HG23 ' A' ' 113' ' ' THR . 7.3 m-85 -72.69 -60.74 2.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 75.430000000000007 110.851 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 108.72 46.36 0.97 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.734 -0.746 . . . . 44.310000000000002 112.487 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -75.55 -43.78 23.15 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.722 -0.751 . . . . 41.520000000000003 112.562 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.412 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 108.34 167.9 21.19 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.77 -0.729 . . . . 71.530000000000001 112.502 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.491 HG13 ' N ' ' A' ' 97' ' ' ASN . 3.1 p -52.33 -50.02 39.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.794 0.33 . . . . 62.219999999999999 111.172 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.491 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.9 OUTLIER -86.66 37.61 0.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.115 -0.493 . . . . 71.140000000000001 110.862 179.951 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.412 ' HB2' ' O ' ' A' ' 95' ' ' GLY . . . -64.6 -75.82 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.449 . . . . 55.140000000000001 111.044 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -44.42 -40.46 5.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.259 -0.428 . . . . 75.239999999999995 110.857 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.2 m -59.68 -74.76 0.07 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 74.310000000000002 110.838 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.617 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 16.3 mtt85 -50.19 -45.77 53.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.075 -0.511 . . . . 64.230000000000004 110.85 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.733 ' HB3' HD12 ' A' ' 74' ' ' ILE . 10.5 m-85 -56.09 -36.36 68.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.221 -0.445 . . . . 64.349999999999994 110.89 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -51.45 -29.23 15.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.473 . . . . 74.530000000000001 110.92 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -108.55 -23.02 12.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 61.219999999999999 110.921 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.09 26.54 8.8 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.723 -0.751 . . . . 73.049999999999997 112.438 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -96.99 -4.85 39.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.805 0.336 . . . . 71.230000000000004 110.888 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.617 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -112.58 8.4 19.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.216 -0.447 . . . . 22.02 111.144 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.515 ' HB2' HD11 ' A' ' 114' ' ' ILE . 2.1 pt20 -125.2 57.1 15.42 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.577 0.703 . . . . 71.140000000000001 110.87 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.54 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.2 Cg_endo -69.82 35.88 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.679 2.253 . . . . 64.450000000000003 112.279 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.786 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 1.1 t-80 74.79 31.28 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.644 0.735 . . . . 74.340000000000003 110.887 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.786 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.9 Cg_endo -69.78 -163.78 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.707 2.272 . . . . 74.129999999999995 112.306 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.14 -29.78 24.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.17 -0.468 . . . . 63.140000000000001 110.84 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.608 HG23 ' HB3' ' A' ' 92' ' ' PHE . 21.9 m -53.06 -52.18 59.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 73.420000000000002 111.134 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.515 HD11 ' HB2' ' A' ' 108' ' ' GLN . 38.8 mm -51.11 -45.14 30.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 62.530000000000001 111.183 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.449 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -65.35 -28.46 69.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 73.219999999999999 110.917 179.796 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.519 ' O ' HD23 ' A' ' 120' ' ' LEU . 5.9 mp -79.53 -42.92 24.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 74.040000000000006 110.905 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.844 HD13 HG22 ' A' ' 74' ' ' ILE . 7.3 mt -62.03 -47.64 83.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 65.230000000000004 110.898 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.587 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.3 ptp180 -54.74 -34.29 62.29 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.192 -0.458 . . . . 60.539999999999999 110.903 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.591 HG23 HD23 ' A' ' 126' ' ' LEU . 32.1 m -94.59 -10.13 9.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.164 -0.471 . . . . 73.219999999999999 111.083 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.759 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.6 OUTLIER -82.57 -40.19 21.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.197 -0.456 . . . . 72.209999999999994 110.924 179.907 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -49.54 -32.79 13.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.452 . . . . 72.409999999999997 110.882 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.52 -21.13 19.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 73.219999999999999 110.905 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.759 ' O ' HD13 ' A' ' 120' ' ' LEU . 66.5 m-70 -129.83 90.26 43.61 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.58 0.705 . . . . 61.530000000000001 110.911 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.693 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.6 Cg_endo -69.71 -0.72 7.28 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.674 2.25 . . . . 63.340000000000003 112.358 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -112.2 -12.39 13.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 74.540000000000006 110.792 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.689 ' O ' HG23 ' A' ' 130' ' ' ILE . 6.5 tp -53.79 -47.84 70.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.259 -0.428 . . . . 71.219999999999999 110.908 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.686 HD13 HD21 ' A' ' 83' ' ' LEU . 2.2 pt? -51.27 -28.67 12.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.212 -0.449 . . . . 64.0 110.905 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.488 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.87 -26.13 24.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 73.409999999999997 110.861 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.409 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.0 OUTLIER -95.78 2.99 54.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 71.439999999999998 110.912 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.689 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.1 pt -121.79 -34.55 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.138 -0.483 . . . . 75.140000000000001 111.117 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.768 ' HB3' HD12 ' A' ' 91' ' ' ILE . 1.7 ptt-85 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.14 -0.482 . . . . 65.420000000000002 110.851 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.603 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 6.2 mmt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.827 0.346 . . . . 71.030000000000001 110.818 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.65 -170.36 0.48 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 75.439999999999998 110.898 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.7 p 177.67 57.54 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.551 0.691 . . . . 43.340000000000003 110.92 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 3.58 2.66 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.672 2.248 . . . . 71.420000000000002 112.302 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 4.9 m -96.38 -42.69 12.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.289 -0.414 . . . . 73.209999999999994 111.172 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -120.54 -33.03 3.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.475 . . . . 61.32 110.922 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 65.29 51.46 1.59 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 72.329999999999998 110.906 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 95.5 mm-40 -118.2 -75.42 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 75.219999999999999 110.949 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.51 -115.63 2.96 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.688 -0.768 . . . . 52.109999999999999 112.475 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.603 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 6.3 pt-20 -174.88 95.38 0.08 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.837 0.351 . . . . 70.420000000000002 110.843 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.537 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.2 ptp -54.71 105.99 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.492 . . . . 75.519999999999996 110.847 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.4 HG12 ' O ' ' A' ' 10' ' ' GLU . 7.1 p -148.57 129.12 4.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 64.129999999999995 111.106 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.536 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -45.22 128.55 7.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.123 -0.49 . . . . 73.310000000000002 110.892 -179.87 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.401 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 179.88 80.0 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.791 -0.718 . . . . 74.040000000000006 112.509 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.402 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -36.8 145.9 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.876 0.369 . . . . 74.439999999999998 111.126 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.23 -167.9 2.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.183 -0.462 . . . . 73.340000000000003 110.933 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -94.39 116.18 28.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 75.120000000000005 110.861 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.757 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.3 mm -108.03 90.87 7.07 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.594 0.711 . . . . 71.030000000000001 111.128 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.49 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 53.0 Cg_endo -69.83 104.07 1.27 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.706 2.27 . . . . 61.100000000000001 112.286 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -71.49 -28.47 63.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.16 -0.473 . . . . 63.409999999999997 110.889 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.531 HG21 ' HG2' ' A' ' 25' ' ' ARG . 27.4 m -131.31 149.42 52.57 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.059 -0.519 . . . . 61.119999999999997 111.14 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.83 41.18 0.76 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.232 -0.44 . . . . 73.400000000000006 110.907 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -129.83 -48.45 1.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 71.450000000000003 110.927 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -146.34 -49.43 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.743 -0.741 . . . . 64.209999999999994 112.533 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.531 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -103.22 46.34 0.92 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.834 0.35 . . . . 74.319999999999993 110.797 -179.834 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.434 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 11.3 tttt -49.52 112.14 0.6 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.263 -0.426 . . . . 73.319999999999993 110.884 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.507 HG21 ' CG ' ' A' ' 60' ' ' PHE . 2.3 t -132.81 96.11 3.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.242 -0.436 . . . . 73.420000000000002 111.182 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.49 ' HA ' ' HA ' ' A' ' 19' ' ' PRO . 0.7 OUTLIER -84.65 140.34 16.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 73.310000000000002 111.164 179.928 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.757 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -86.58 63.7 8.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 62.310000000000002 110.929 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -42.36 104.39 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 71.219999999999999 110.913 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.49 ' O ' HD13 ' A' ' 32' ' ' ILE . . . 117.53 60.47 0.3 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.706 -0.759 . . . . 72.209999999999994 112.554 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.589 HD11 ' CB ' ' A' ' 29' ' ' LEU . 18.2 mm -116.63 93.05 2.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.856 0.36 . . . . 61.5 111.117 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.43 157.38 34.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 61.350000000000001 110.932 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 163.48 -106.77 0.28 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.769 -0.729 . . . . 52.539999999999999 112.533 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.747 HD12 ' HB ' ' A' ' 44' ' ' ILE . 49.6 mt -156.53 83.44 0.97 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.886 0.374 . . . . 71.400000000000006 110.966 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.57 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -167.64 169.5 11.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 74.140000000000001 110.994 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -178.88 -34.77 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.199 -0.455 . . . . 73.400000000000006 110.927 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.5 m -122.28 -44.99 2.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 53.439999999999998 111.138 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -98.53 177.45 5.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 71.530000000000001 110.862 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 29.0 p -148.47 26.51 0.94 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.209 -0.45 . . . . 74.129999999999995 110.911 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.8 mp0 -100.66 -76.75 0.55 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.138 -0.483 . . . . 54.200000000000003 110.859 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -78.38 59.54 2.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.076 -0.511 . . . . 65.019999999999996 110.923 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.2 p -84.39 159.25 20.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.072 -0.513 . . . . 74.120000000000005 110.82 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.747 ' HB ' HD12 ' A' ' 35' ' ' LEU . 28.2 mm -142.81 140.61 27.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.082 -0.508 . . . . 74.120000000000005 111.103 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.0 mtm -145.4 135.11 23.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 73.230000000000004 110.928 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -81.53 -170.08 2.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.294 -0.412 . . . . 64.129999999999995 110.879 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.34 -58.96 5.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 53.329999999999998 110.922 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -52.73 -56.99 11.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 74.319999999999993 110.843 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.75 -59.28 4.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 70.329999999999998 110.912 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.8 t -53.31 -38.27 63.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 71.310000000000002 110.864 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.69 -43.71 98.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 72.140000000000001 110.838 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.08 -57.5 8.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 63.450000000000003 111.008 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -55.01 -47.3 74.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.256 -0.429 . . . . 75.510000000000005 110.84 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.413 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.95 -48.87 74.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.213 -0.449 . . . . 72.25 110.916 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.97 -41.75 64.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 62.539999999999999 111.084 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.749 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.7 OUTLIER -69.52 -66.35 0.6 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 50.130000000000003 110.904 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.479 HG23 ' N ' ' A' ' 58' ' ' LYS . 27.2 m -47.4 -42.52 7.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 74.129999999999995 111.074 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.479 ' N ' HG23 ' A' ' 57' ' ' VAL . 3.7 mmtp -64.03 -50.76 67.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 73.219999999999999 110.836 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.53 -50.71 52.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 72.219999999999999 111.099 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.507 ' CG ' HG21 ' A' ' 27' ' ' THR . 0.3 OUTLIER -67.82 -43.95 78.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.233 -0.439 . . . . 72.140000000000001 110.924 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 36.5 mtp85 -51.04 -43.95 61.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 72.019999999999996 110.895 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.33 -55.42 8.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 75.129999999999995 111.097 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.83 -37.93 53.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 54.299999999999997 110.839 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.41 HG12 ' O ' ' A' ' 60' ' ' PHE . 5.2 p -84.86 -22.82 7.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 72.400000000000006 111.093 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.84 -23.99 55.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 74.219999999999999 110.9 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.42 -25.66 50.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 75.049999999999997 111.095 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -63.78 -169.83 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 75.409999999999997 110.846 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 54.1 m -134.96 -76.94 0.45 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 74.540000000000006 111.124 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.511 HG11 HG23 ' A' ' 74' ' ' ILE . 0.9 OUTLIER -150.14 143.56 17.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 73.319999999999993 111.123 179.949 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.602 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -82.27 160.81 61.71 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.55 0.691 . . . . 43.119999999999997 111.071 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.602 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.4 Cg_endo -69.75 -7.63 21.55 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.632 2.222 . . . . 72.519999999999996 112.413 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -101.16 -36.28 9.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 71.530000000000001 110.919 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -56.6 -61.4 2.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 71.329999999999998 110.922 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.783 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.33 -68.7 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 74.209999999999994 111.089 179.944 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 28.1 m -48.53 -39.23 10.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 71.120000000000005 111.143 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.1 mtmt -60.68 -39.59 88.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 74.409999999999997 110.872 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.53 HG22 ' HB2' ' A' ' 121' ' ' ASP . 90.2 t -70.14 -36.91 70.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.189 -0.459 . . . . 74.5 111.126 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.3 OUTLIER -69.96 -34.27 73.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.192 -0.458 . . . . 54.240000000000002 110.917 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.7 ptpt -88.73 -19.78 25.65 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.181 -0.463 . . . . 74.109999999999999 110.861 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.469 ' HG2' HD23 ' A' ' 81' ' ' LEU . 3.1 ttmt -75.85 -50.63 14.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.258 -0.428 . . . . 71.230000000000004 110.87 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.824 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.1 mt -91.27 13.14 18.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.274 -0.421 . . . . 64.349999999999994 110.932 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 7.5 t 52.22 41.18 30.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 54.039999999999999 110.857 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.824 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.6 mm? -79.48 85.0 5.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 70.209999999999994 110.913 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.598 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -46.84 155.99 0.23 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 63.520000000000003 111.143 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -59.1 -20.62 55.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 75.239999999999995 110.902 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.01 -53.57 6.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 73.010000000000005 110.922 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.598 ' H ' HG23 ' A' ' 84' ' ' THR . 0.6 OUTLIER -65.9 -53.79 34.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 64.099999999999994 110.885 179.953 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.481 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -51.49 -31.87 25.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 73.150000000000006 111.046 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 44.4 t -80.24 -39.95 28.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.266 -0.425 . . . . 62.399999999999999 110.795 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -71.69 -20.89 61.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.473 . . . . 63.229999999999997 110.861 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.711 ' CD1' HD12 ' A' ' 127' ' ' LEU . 53.3 mt -104.31 -64.05 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 61.130000000000003 111.098 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.535 ' HB3' HG23 ' A' ' 113' ' ' THR . 8.7 m-85 -74.58 -61.15 1.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 75.430000000000007 110.834 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 113.09 47.96 0.63 Allowed Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.7 -0.762 . . . . 44.310000000000002 112.494 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.631 ' C ' ' HB2' ' A' ' 98' ' ' ALA . . . -68.04 -38.46 88.48 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.753 -0.737 . . . . 41.520000000000003 112.472 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 98.72 -164.94 20.98 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.768 -0.73 . . . . 71.530000000000001 112.489 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 5.2 t -71.41 -70.71 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.805 0.336 . . . . 62.219999999999999 111.107 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 26.1 t30 -84.87 39.41 0.75 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 71.140000000000001 110.847 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.631 ' HB2' ' C ' ' A' ' 94' ' ' GLY . . . -61.54 -71.69 0.14 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 55.140000000000001 111.016 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -41.15 -42.74 2.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 75.239999999999995 110.872 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.44 -74.72 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.162 -0.472 . . . . 74.310000000000002 110.86 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.606 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 10.0 mtt180 -48.27 -49.45 33.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.095 -0.502 . . . . 64.230000000000004 110.924 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.536 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.4 m-85 -53.8 -37.23 63.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 64.349999999999994 110.901 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -53.36 -34.65 58.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.135 -0.484 . . . . 74.530000000000001 110.88 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.61 -19.83 16.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 61.219999999999999 110.9 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.08 26.74 11.9 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.775 -0.726 . . . . 73.049999999999997 112.444 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -98.82 -6.16 29.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.882 0.372 . . . . 71.230000000000004 110.898 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.606 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -117.44 17.58 14.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.479 . . . . 22.02 111.099 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.429 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 1.9 pt20 -126.48 55.31 13.54 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.552 0.692 . . . . 71.140000000000001 110.944 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.497 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.0 Cg_endo -69.8 38.5 0.26 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.667 2.245 . . . . 64.450000000000003 112.37 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.732 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.7 t60 71.63 34.9 0.08 OUTLIER Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 121.604 0.716 . . . . 74.340000000000003 110.88 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.732 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.1 Cg_endo -69.82 -163.88 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.184 0 C-N-CA 122.714 2.276 . . . . 74.129999999999995 112.319 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 83.9 p -86.82 -29.56 22.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 63.140000000000001 110.889 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.535 HG23 ' HB3' ' A' ' 92' ' ' PHE . 18.8 m -56.25 -47.19 79.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.09 -0.505 . . . . 73.420000000000002 111.114 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.43 HG23 HG21 ' A' ' 69' ' ' VAL . 47.5 mm -56.29 -44.83 80.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 62.530000000000001 111.182 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.417 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -66.74 -28.97 68.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.108 -0.496 . . . . 73.219999999999999 110.892 179.845 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.52 ' CD2' HD12 ' A' ' 130' ' ' ILE . 5.6 mp -79.36 -42.12 26.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.259 -0.428 . . . . 74.040000000000006 110.945 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.783 HD13 HG22 ' A' ' 74' ' ' ILE . 19.3 mt -63.57 -48.84 75.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.241 -0.436 . . . . 65.230000000000004 110.917 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.593 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.3 ptp180 -52.61 -35.4 54.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 60.539999999999999 110.889 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.593 HG13 ' HG3' ' A' ' 118' ' ' ARG . 28.8 m -93.09 -13.36 8.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 73.219999999999999 111.11 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.747 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -78.05 -40.23 39.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 72.209999999999994 110.899 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.53 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.6 OUTLIER -49.95 -30.91 11.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.124 -0.489 . . . . 72.409999999999997 110.88 179.848 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.7 -20.3 17.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 73.219999999999999 110.895 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.747 ' O ' HD13 ' A' ' 120' ' ' LEU . 40.6 m-70 -127.98 87.73 54.89 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.557 0.694 . . . . 61.530000000000001 110.826 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.568 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.9 Cg_endo -69.78 3.42 2.79 Favored 'Trans proline' 0 N--CA 1.465 -0.174 0 C-N-CA 122.686 2.258 . . . . 63.340000000000003 112.384 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -117.19 -12.75 10.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 74.540000000000006 110.859 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.666 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.3 tp -53.95 -46.91 71.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 71.219999999999999 110.919 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.711 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.48 -29.64 6.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.476 . . . . 64.0 110.872 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.516 HD21 HH12 ' A' ' 131' ' ' ARG . 6.3 m120 -86.42 -28.37 23.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 73.409999999999997 110.891 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.423 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -93.29 4.36 54.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.185 -0.461 . . . . 71.439999999999998 110.855 179.996 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.666 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.0 pt -123.24 -35.03 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 75.140000000000001 111.163 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.516 HH12 HD21 ' A' ' 128' ' ' ASN . 1.8 ptt-85 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.481 . . . . 65.420000000000002 110.89 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 mmt . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.882 0.373 . . . . 71.030000000000001 110.874 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.35 -169.64 0.46 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.446 . . . . 75.439999999999998 110.92 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 1.7 p 178.78 55.74 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.592 0.71 . . . . 43.340000000000003 110.891 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 53.5 Cg_endo -69.77 -8.64 24.12 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.674 2.249 . . . . 71.420000000000002 112.346 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.664 HG21 ' CD ' ' A' ' 42' ' ' GLU . 6.8 m -67.49 -49.48 70.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.198 -0.455 . . . . 73.209999999999994 111.082 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.455 ' N ' HG23 ' A' ' 5' ' ' VAL . 1.2 m -133.3 -20.98 2.08 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.187 -0.461 . . . . 61.32 110.933 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 66.58 89.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 72.329999999999998 110.874 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.416 ' NE2' ' HB3' ' A' ' 6' ' ' CYS . 14.1 mp0 -132.14 -65.89 0.72 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 75.219999999999999 110.94 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.524 ' HA3' HG13 ' A' ' 38' ' ' VAL . . . -129.54 -95.4 0.77 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.739 -0.744 . . . . 52.109999999999999 112.464 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.586 ' HG2' HG12 ' A' ' 38' ' ' VAL . 7.1 pt-20 -177.67 95.3 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.805 0.336 . . . . 70.420000000000002 110.866 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.567 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -62.27 102.65 0.32 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 75.519999999999996 110.851 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.9 p -143.88 128.52 14.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 64.129999999999995 111.114 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.627 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -48.42 129.63 16.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 73.310000000000002 110.861 -179.829 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.404 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 178.05 81.15 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.74 -0.743 . . . . 74.040000000000006 112.545 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.408 HD12 ' N ' ' A' ' 15' ' ' ILE . 0.8 OUTLIER -36.8 146.22 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.843 0.354 . . . . 74.439999999999998 111.13 -179.951 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.32 -165.48 1.59 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.138 -0.483 . . . . 73.340000000000003 110.912 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.674 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.7 OUTLIER -94.24 118.21 31.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.305 -0.407 . . . . 75.120000000000005 110.92 179.85 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.746 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.1 mm -109.87 90.99 10.02 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.593 0.711 . . . . 71.030000000000001 111.158 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.455 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.2 Cg_endo -69.84 96.29 0.59 Allowed 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.704 2.269 . . . . 61.100000000000001 112.26 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -63.18 -36.44 83.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 63.409999999999997 110.964 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.534 HG21 ' HG2' ' A' ' 25' ' ' ARG . 58.8 m -129.33 151.43 49.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.109 -0.496 . . . . 61.119999999999997 111.117 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -146.1 40.37 1.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 73.400000000000006 110.869 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.461 ' H ' HG22 ' A' ' 21' ' ' THR . 5.7 mtt85 -125.21 -57.37 1.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 71.450000000000003 110.856 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -145.52 -39.21 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.803 -0.713 . . . . 64.209999999999994 112.501 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.534 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -105.19 40.8 1.45 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.826 0.346 . . . . 74.319999999999993 110.863 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.472 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 0.7 OUTLIER -51.03 115.16 1.4 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 73.319999999999993 110.9 179.924 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 27' ' ' THR . 1.8 t -128.98 94.87 3.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.254 -0.43 . . . . 73.420000000000002 111.154 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.674 HG11 ' HB2' ' A' ' 17' ' ' ASP . 48.3 t -78.3 127.61 38.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 73.310000000000002 111.13 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.746 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.3 OUTLIER -84.39 51.68 2.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.124 -0.489 . . . . 62.310000000000002 110.852 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 29' ' ' LEU . 35.5 mttp -37.4 107.51 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.256 -0.429 . . . . 71.219999999999999 110.871 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.19 48.11 0.4 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.743 -0.741 . . . . 72.209999999999994 112.506 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.6 HD11 ' HB3' ' A' ' 29' ' ' LEU . 18.7 mm -108.07 92.38 2.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.842 0.353 . . . . 61.5 111.181 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.8 153.52 38.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 61.350000000000001 110.863 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.64 -108.62 0.31 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.774 -0.727 . . . . 52.539999999999999 112.459 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.753 HD12 ' HB ' ' A' ' 44' ' ' ILE . 48.8 mt -156.74 86.24 0.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.879 0.371 . . . . 71.400000000000006 110.898 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.44 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.83 162.79 32.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 74.140000000000001 110.858 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.0 t -164.7 -39.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.082 -0.508 . . . . 73.400000000000006 110.924 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.586 HG12 ' HG2' ' A' ' 10' ' ' GLU . 5.5 p -129.86 -44.13 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 53.439999999999998 111.123 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.439 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -90.79 169.81 10.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.203 -0.453 . . . . 71.530000000000001 110.784 179.993 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.2 p -134.92 6.92 3.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.485 . . . . 74.129999999999995 110.931 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -93.73 -65.3 1.0 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.474 . . . . 54.200000000000003 110.904 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.664 ' CD ' HG21 ' A' ' 5' ' ' VAL . 16.1 tp10 -75.95 61.4 1.49 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 65.019999999999996 110.902 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.9 p -100.64 158.59 15.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 74.120000000000005 110.835 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.753 ' HB ' HD12 ' A' ' 35' ' ' LEU . 20.8 mm -142.81 140.01 27.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.149 -0.478 . . . . 74.120000000000005 111.114 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.7 mtt -143.75 133.88 24.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 73.230000000000004 110.889 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.3 m-20 -86.19 -169.87 2.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 64.129999999999995 110.869 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.87 -59.12 5.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 53.329999999999998 110.909 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -53.79 -56.53 16.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 74.319999999999993 110.926 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.29 -59.56 4.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.074 -0.512 . . . . 70.329999999999998 110.944 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.5 t -54.17 -39.38 66.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.486 . . . . 71.310000000000002 110.867 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.8 -45.47 89.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.128 -0.487 . . . . 72.140000000000001 110.857 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.81 -58.96 4.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.193 -0.458 . . . . 63.450000000000003 111.137 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.464 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.1 t80 -53.99 -47.8 71.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.189 -0.46 . . . . 75.510000000000005 110.899 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.408 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.28 -48.77 76.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.131 -0.486 . . . . 72.25 110.901 179.946 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.25 -41.77 63.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 62.539999999999999 111.05 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.741 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -70.19 -66.62 0.57 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 50.130000000000003 110.886 -179.877 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.464 HG13 ' O ' ' A' ' 53' ' ' PHE . 13.5 m -47.32 -35.3 3.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 74.129999999999995 111.164 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.3 mmmt -70.29 -52.35 23.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 73.219999999999999 110.888 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.48 -50.77 59.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.251 -0.431 . . . . 72.219999999999999 111.138 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.65 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -65.14 -47.63 76.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.438 . . . . 72.140000000000001 110.834 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.11 -51.75 40.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.132 -0.485 . . . . 72.019999999999996 110.895 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.78 -54.76 34.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 75.129999999999995 111.08 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.19 -42.53 40.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 54.299999999999997 110.796 -179.712 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 60' ' ' PHE . 37.5 t -76.56 -27.32 17.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.435 . . . . 72.400000000000006 111.143 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.91 -19.45 60.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 74.219999999999999 110.916 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.35 -21.97 64.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.47 . . . . 75.049999999999997 111.055 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -54.62 -75.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 75.409999999999997 110.922 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.755 HG22 HG13 ' A' ' 69' ' ' VAL . 93.6 m -134.42 -75.97 0.47 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.159 -0.473 . . . . 74.540000000000006 111.176 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.755 HG13 HG22 ' A' ' 68' ' ' THR . 17.2 m -149.55 -172.95 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 73.319999999999993 111.126 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.464 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.3 156.93 36.08 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.589 0.709 . . . . 43.119999999999997 111.131 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.48 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.3 Cg_endo -69.83 -7.95 22.38 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.699 2.266 . . . . 72.519999999999996 112.314 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.32 -34.68 10.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.446 . . . . 71.530000000000001 110.822 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.404 ' CE1' ' HA ' ' A' ' 118' ' ' ARG . 12.9 t80 -58.93 -61.15 2.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 71.329999999999998 110.864 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.841 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -43.91 -66.39 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.209999999999994 111.145 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.1 m -50.95 -38.64 18.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 71.120000000000005 111.068 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt -59.54 -47.8 84.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 74.409999999999997 110.912 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.5 t -60.78 -39.54 82.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.152 -0.476 . . . . 74.5 111.094 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.2 OUTLIER -62.14 -58.77 6.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 54.240000000000002 110.86 -179.936 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -19.97 65.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 74.109999999999999 110.865 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.3 ttmm -69.33 -55.83 9.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 71.230000000000004 110.853 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.716 HD13 HD12 ' A' ' 120' ' ' LEU . 7.1 mt -91.39 15.12 12.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.267 -0.424 . . . . 64.349999999999994 110.914 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 53.4 39.26 29.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 54.039999999999999 110.832 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.701 HD22 ' CE2' ' A' ' 92' ' ' PHE . 0.4 OUTLIER -79.84 87.09 5.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.137 -0.483 . . . . 70.209999999999994 110.921 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.598 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.39 156.74 0.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.162 -0.472 . . . . 63.520000000000003 111.178 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -58.78 -21.47 55.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 75.239999999999995 110.902 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.47 -54.19 6.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 73.010000000000005 110.917 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.598 ' H ' HG23 ' A' ' 84' ' ' THR . 0.7 OUTLIER -61.48 -53.15 60.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 64.099999999999994 110.921 179.897 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.42 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -51.57 -32.46 28.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.083 -0.508 . . . . 73.150000000000006 111.077 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 4.3 m -80.72 -34.44 34.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.296 -0.411 . . . . 62.399999999999999 110.856 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -76.26 -21.61 56.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.101 -0.499 . . . . 63.229999999999997 110.868 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.742 ' CD1' HD12 ' A' ' 127' ' ' LEU . 40.6 mt -105.65 -62.22 2.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.446 . . . . 61.130000000000003 111.113 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.701 ' CE2' HD22 ' A' ' 83' ' ' LEU . 5.4 m-85 -75.69 -63.22 1.35 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 75.430000000000007 110.897 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 115.54 48.72 0.5 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.736 -0.745 . . . . 44.310000000000002 112.516 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -70.37 -37.06 70.15 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.738 -0.744 . . . . 41.520000000000003 112.453 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 103.87 -160.0 16.37 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.743 -0.742 . . . . 71.530000000000001 112.464 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.8 t -76.7 -69.93 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.927 0.394 . . . . 62.219999999999999 111.14 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -85.37 44.09 1.07 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.467 . . . . 71.140000000000001 110.893 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -59.05 -75.58 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 55.140000000000001 111.09 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.403 ' C ' ' O ' ' A' ' 98' ' ' ALA . 36.6 m-85 -37.75 -43.26 0.64 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.216 -0.447 . . . . 75.239999999999995 110.924 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.2 t -58.31 -75.86 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 74.310000000000002 110.859 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.617 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 20.9 mtt180 -49.45 -49.24 46.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 64.230000000000004 110.851 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.595 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.4 m-85 -53.0 -36.21 60.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 64.349999999999994 110.916 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -52.72 -36.29 57.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 74.530000000000001 110.856 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.79 -19.6 16.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 61.219999999999999 110.903 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.78 24.46 13.35 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.768 -0.73 . . . . 73.049999999999997 112.507 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 29.3 m120 -95.58 -5.78 41.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.803 0.335 . . . . 71.230000000000004 110.876 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.617 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -115.02 17.43 16.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 22.02 111.133 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.566 ' HB2' HD11 ' A' ' 114' ' ' ILE . 1.8 pt20 -129.49 56.03 21.86 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.603 0.716 . . . . 71.140000000000001 110.889 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.514 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.6 Cg_endo -69.75 38.67 0.26 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.734 2.289 . . . . 64.450000000000003 112.339 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.745 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER 72.05 34.21 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.547 0.689 . . . . 74.340000000000003 110.849 179.971 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.745 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.1 Cg_endo -69.81 -164.5 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.632 2.222 . . . . 74.129999999999995 112.34 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 4.1 p -88.94 -27.15 21.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.138 -0.483 . . . . 63.140000000000001 110.932 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.569 HG23 ' HB3' ' A' ' 92' ' ' PHE . 8.3 m -56.94 -49.85 74.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.058 -0.519 . . . . 73.420000000000002 111.121 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.566 HD11 ' HB2' ' A' ' 108' ' ' GLN . 36.5 mm -47.5 -45.75 10.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 62.530000000000001 111.169 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.708 ' HD3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -65.39 -46.98 77.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.475 . . . . 73.219999999999999 110.818 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.708 HD12 ' HD3' ' A' ' 115' ' ' LYS . 7.8 mp -60.16 -34.15 73.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.273 -0.421 . . . . 74.040000000000006 111.002 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.841 HD13 HG22 ' A' ' 74' ' ' ILE . 25.4 mt -69.69 -56.79 6.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 65.230000000000004 110.907 179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.47 ' HG3' HG13 ' A' ' 119' ' ' VAL . 11.5 ptp180 -51.0 -34.09 27.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.152 -0.476 . . . . 60.539999999999999 110.911 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.518 HG23 HD23 ' A' ' 126' ' ' LEU . 18.6 m -87.71 -20.31 7.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.155 -0.475 . . . . 73.219999999999999 111.136 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.754 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -75.21 -40.51 59.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.136 -0.484 . . . . 72.209999999999994 110.891 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -49.89 -31.42 12.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 72.409999999999997 110.825 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -94.99 -21.21 18.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 73.219999999999999 110.937 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.754 ' O ' HD13 ' A' ' 120' ' ' LEU . 91.7 m-70 -131.37 91.69 34.3 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.626 0.727 . . . . 61.530000000000001 110.846 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.621 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.8 Cg_endo -69.77 0.7 5.28 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.699 2.266 . . . . 63.340000000000003 112.316 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -114.45 -13.02 12.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.208 -0.451 . . . . 74.540000000000006 110.9 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.518 HD23 HG23 ' A' ' 119' ' ' VAL . 6.3 tp -53.06 -49.28 66.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.143 -0.481 . . . . 71.219999999999999 110.913 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.742 HD12 ' CD1' ' A' ' 91' ' ' ILE . 2.6 pt? -46.65 -32.55 3.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 64.0 110.956 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.39 -38.44 26.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 73.409999999999997 110.929 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.582 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.7 OUTLIER -78.09 -7.59 57.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 71.439999999999998 110.891 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.582 HG23 ' HG3' ' A' ' 129' ' ' GLU . 7.1 pt -118.73 -17.03 7.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.164 -0.471 . . . . 75.140000000000001 111.122 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 65.420000000000002 110.903 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.81 0.338 . . . . 71.030000000000001 110.858 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.495 ' O ' ' HB2' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -174.69 -170.6 0.5 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 75.439999999999998 110.864 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 49.6 t 176.11 59.49 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.613 0.72 . . . . 43.340000000000003 110.867 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 1.04 4.82 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.638 2.225 . . . . 71.420000000000002 112.328 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.469 HG23 ' N ' ' A' ' 6' ' ' CYS . 34.1 m -87.84 -42.63 15.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 73.209999999999994 111.136 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.469 ' N ' HG23 ' A' ' 5' ' ' VAL . 1.2 t -126.97 -24.33 3.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 61.32 110.918 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.432 ' N ' ' O ' ' A' ' 3' ' ' CYS . 16.2 m-70 62.92 47.67 4.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 72.329999999999998 110.785 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -102.25 -75.26 0.6 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 75.219999999999999 110.914 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -110.77 -137.95 7.63 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.694 -0.765 . . . . 52.109999999999999 112.56 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -144.54 104.48 4.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.85 0.357 . . . . 70.420000000000002 110.877 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.558 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -67.43 107.25 2.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 75.519999999999996 110.914 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -146.97 130.89 9.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 64.129999999999995 111.121 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.563 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -47.99 132.24 15.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 73.310000000000002 110.895 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.41 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 177.18 79.69 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.751 -0.738 . . . . 74.040000000000006 112.514 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.41 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.88 146.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.913 0.387 . . . . 74.439999999999998 111.095 -179.941 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.09 -165.72 1.67 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 73.340000000000003 110.913 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.697 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -94.88 116.73 29.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.241 -0.436 . . . . 75.120000000000005 110.91 179.843 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.746 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.0 mm -107.93 90.74 6.81 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.616 0.722 . . . . 71.030000000000001 111.138 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.481 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.73 96.12 0.58 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.706 2.271 . . . . 61.100000000000001 112.332 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.0 t80 -64.58 -35.96 82.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 63.409999999999997 110.84 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.492 HG21 ' HG2' ' A' ' 25' ' ' ARG . 20.2 m -131.35 152.35 50.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.457 . . . . 61.119999999999997 111.16 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -155.29 37.64 0.39 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.257 -0.429 . . . . 73.400000000000006 110.935 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.38 -34.0 1.86 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.157 -0.474 . . . . 71.450000000000003 110.89 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -156.91 -51.0 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.741 -0.742 . . . . 64.209999999999994 112.468 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.492 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -107.71 53.14 0.7 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.859 0.361 . . . . 74.319999999999993 110.883 -179.859 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.408 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 19.4 tttt -56.73 121.11 9.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.487 . . . . 73.319999999999993 110.909 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.414 ' O ' HG23 ' A' ' 27' ' ' THR . 1.8 t -136.8 92.95 2.79 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.288 -0.415 . . . . 73.420000000000002 111.144 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.697 HG11 ' HB2' ' A' ' 17' ' ' ASP . 45.8 t -77.3 128.12 38.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 73.310000000000002 111.151 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.752 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.67 51.88 2.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.188 -0.46 . . . . 62.310000000000002 110.908 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.401 ' C ' ' O ' ' A' ' 29' ' ' LEU . 30.5 mttp -37.25 107.24 0.06 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 71.219999999999999 110.903 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.7 50.03 0.37 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.797 -0.716 . . . . 72.209999999999994 112.526 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.594 HD11 ' HB3' ' A' ' 29' ' ' LEU . 19.1 mm -109.46 92.65 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.894 0.378 . . . . 61.5 111.18 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.42 154.0 37.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 61.350000000000001 110.843 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.64 -108.46 0.31 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.78 -0.724 . . . . 52.539999999999999 112.497 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.755 HD12 ' HB ' ' A' ' 44' ' ' ILE . 61.0 mt -156.67 86.16 0.99 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.85 0.357 . . . . 71.400000000000006 110.986 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.445 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -161.45 164.3 29.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.15 -0.477 . . . . 74.140000000000001 110.923 -179.931 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 9.9 t -169.29 -44.33 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 73.400000000000006 110.835 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.0 m -120.69 -47.41 2.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 53.439999999999998 111.148 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.88 172.71 8.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 71.530000000000001 110.895 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.8 t -138.15 9.86 2.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.425 . . . . 74.129999999999995 110.951 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -97.91 -63.31 1.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 54.200000000000003 110.929 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -76.66 60.59 1.7 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.14 -0.482 . . . . 65.019999999999996 110.933 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.9 p -98.3 158.65 15.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 74.120000000000005 110.854 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.755 ' HB ' HD12 ' A' ' 35' ' ' LEU . 18.3 mm -144.31 139.39 24.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 74.120000000000005 111.169 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.8 mtt -142.06 137.51 31.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.192 -0.458 . . . . 73.230000000000004 110.975 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 40.9 m-20 -89.05 -169.52 2.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 64.129999999999995 110.887 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? -54.78 -59.8 4.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 53.329999999999998 110.857 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -56.84 13.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 74.319999999999993 110.905 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.02 -59.43 4.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.105 -0.498 . . . . 70.329999999999998 110.92 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.9 t -53.62 -41.23 66.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.127 -0.488 . . . . 71.310000000000002 110.89 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -57.6 -45.23 85.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 72.140000000000001 110.876 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.62 -61.04 2.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 63.450000000000003 111.084 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.447 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.5 t80 -52.49 -48.37 65.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 75.510000000000005 110.92 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.431 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.32 -49.32 76.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 72.25 110.842 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.43 -41.71 61.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 62.539999999999999 111.068 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.752 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -70.18 -67.38 0.5 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.449 . . . . 50.130000000000003 110.89 -179.881 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.0 m -46.98 -35.74 3.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 74.129999999999995 111.142 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -69.52 -54.25 15.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 73.219999999999999 110.92 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.25 -51.75 31.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 72.219999999999999 111.124 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.661 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -63.66 -49.13 74.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.167 -0.47 . . . . 72.140000000000001 110.876 -179.874 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.65 -36.68 36.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.043 -0.526 . . . . 72.019999999999996 110.805 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.12 -54.01 9.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.292 -0.413 . . . . 75.129999999999995 111.06 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.29 -28.57 65.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 54.299999999999997 110.837 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.661 HG22 ' O ' ' A' ' 60' ' ' PHE . 19.9 m -94.14 -17.38 7.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.147 -0.479 . . . . 72.400000000000006 111.185 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -30.98 69.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 74.219999999999999 110.935 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.91 -18.86 59.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 75.049999999999997 111.136 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -60.33 -75.22 0.06 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.223 -0.444 . . . . 75.409999999999997 110.906 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.757 HG22 HG13 ' A' ' 69' ' ' VAL . 93.1 m -53.61 -76.14 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.074 -0.512 . . . . 74.540000000000006 111.094 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.757 HG13 HG22 ' A' ' 68' ' ' THR . 17.0 m -149.39 -172.44 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.236 -0.438 . . . . 73.319999999999993 111.054 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.403 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -105.92 155.45 38.32 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.52 0.676 . . . . 43.119999999999997 111.08 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.471 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.1 Cg_endo -69.68 -6.93 19.74 Favored 'Trans proline' 0 N--CA 1.465 -0.156 0 C-N-CA 122.708 2.272 . . . . 72.519999999999996 112.355 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.06 -34.78 9.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 71.530000000000001 110.905 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.661 ' O ' HG23 ' A' ' 77' ' ' VAL . 16.4 t80 -58.34 -61.83 2.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 71.329999999999998 110.834 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.92 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -39.54 -69.98 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.15 -0.477 . . . . 74.209999999999994 111.105 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.41 HG23 ' N ' ' A' ' 76' ' ' LYS . 35.9 m -49.37 -39.81 13.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 71.120000000000005 111.136 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.41 ' N ' HG23 ' A' ' 75' ' ' VAL . 7.5 mtmt -61.46 -38.29 86.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.152 -0.476 . . . . 74.409999999999997 110.894 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 73' ' ' PHE . 16.6 t -69.81 -38.15 75.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.245 -0.434 . . . . 74.5 111.123 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.2 OUTLIER -69.93 -33.33 72.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.138 -0.483 . . . . 54.240000000000002 110.866 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -88.05 -21.83 24.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.149 -0.478 . . . . 74.109999999999999 110.924 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.488 ' HG2' HD23 ' A' ' 81' ' ' LEU . 18.7 ttmt -74.16 -50.5 19.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.204 -0.453 . . . . 71.230000000000004 110.897 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.799 ' HB2' HD23 ' A' ' 83' ' ' LEU . 12.8 mt -89.71 12.05 18.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.244 -0.434 . . . . 64.349999999999994 111.003 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 65.3 m 53.14 39.8 30.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.149 -0.478 . . . . 54.039999999999999 110.888 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.799 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.7 mm? -79.56 83.99 5.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.125 -0.489 . . . . 70.209999999999994 110.891 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.593 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.43 157.3 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.16 -0.473 . . . . 63.520000000000003 111.164 179.913 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -56.29 -23.19 35.07 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.245 -0.434 . . . . 75.239999999999995 110.921 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.4 mmtp -80.0 -47.1 15.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 73.010000000000005 110.916 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.593 ' H ' HG23 ' A' ' 84' ' ' THR . 8.9 tp10 -67.22 -56.25 10.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.271 -0.422 . . . . 64.099999999999994 110.827 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.432 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -50.79 -38.67 49.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 73.150000000000006 111.045 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 96.6 p -77.53 -32.3 53.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 62.399999999999999 110.86 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -73.72 -28.86 61.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 63.229999999999997 110.925 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.774 HD12 ' HB3' ' A' ' 131' ' ' ARG . 11.4 mm -99.92 -63.59 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 61.130000000000003 111.192 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.647 ' HB3' HG23 ' A' ' 113' ' ' THR . 8.9 m-85 -70.08 -61.57 1.73 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.128 -0.487 . . . . 75.430000000000007 110.863 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 111.95 41.66 1.07 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.755 -0.736 . . . . 44.310000000000002 112.458 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -57.83 -44.95 94.07 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.698 -0.763 . . . . 41.520000000000003 112.495 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.69 -151.2 16.95 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.799 -0.715 . . . . 71.530000000000001 112.505 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.0 t -85.41 -69.1 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.822 0.344 . . . . 62.219999999999999 111.104 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -83.33 39.58 0.67 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 71.140000000000001 110.876 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.21 -79.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.119 -0.491 . . . . 55.140000000000001 111.112 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -37.68 -43.07 0.61 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.343 -0.39 . . . . 75.239999999999995 110.874 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.0 -76.45 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 74.310000000000002 110.833 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.55 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 55.7 mtt180 -50.09 -49.46 51.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 64.230000000000004 110.897 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.486 ' HB3' HD12 ' A' ' 74' ' ' ILE . 8.9 m-85 -51.17 -37.35 45.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.241 -0.436 . . . . 64.349999999999994 110.88 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -51.22 -38.33 51.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 74.530000000000001 110.871 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.95 -18.56 17.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.105 -0.498 . . . . 61.219999999999999 110.902 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.94 26.32 11.71 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.723 -0.751 . . . . 73.049999999999997 112.539 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -96.37 -4.18 42.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.892 0.377 . . . . 71.230000000000004 110.911 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.55 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -120.69 18.4 11.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 22.02 111.093 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.444 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.8 pt20 -126.28 55.91 14.9 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.661 0.743 . . . . 71.140000000000001 110.932 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.494 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.4 Cg_endo -69.74 36.51 0.23 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.698 2.266 . . . . 64.450000000000003 112.327 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.743 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 4.7 t-160 71.67 34.27 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.576 0.703 . . . . 74.340000000000003 110.881 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.743 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.3 Cg_endo -69.79 -164.26 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.648 2.232 . . . . 74.129999999999995 112.33 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 28.3 t -83.64 -30.82 26.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.145 -0.48 . . . . 63.140000000000001 110.876 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.68 HG22 ' CD1' ' A' ' 117' ' ' LEU . 54.1 m -54.94 -50.68 68.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.108 -0.496 . . . . 73.420000000000002 111.102 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.731 HG21 ' CG2' ' A' ' 68' ' ' THR . 44.0 mm -54.21 -47.75 67.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 62.530000000000001 111.13 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -28.59 70.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.462 . . . . 73.219999999999999 110.968 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.523 ' O ' HD23 ' A' ' 120' ' ' LEU . 5.1 mp -79.59 -42.01 25.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 74.040000000000006 110.932 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.92 HD13 HG22 ' A' ' 74' ' ' ILE . 4.4 mt -61.48 -48.55 80.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 65.230000000000004 110.917 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.527 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.9 ptp180 -54.06 -35.32 61.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 60.539999999999999 110.867 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.584 HG23 HD23 ' A' ' 126' ' ' LEU . 34.5 m -92.97 -10.65 9.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 73.219999999999999 111.159 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.747 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.7 OUTLIER -83.42 -39.98 19.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 72.209999999999994 110.898 179.971 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -50.33 -31.68 15.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 72.409999999999997 110.859 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.16 -19.66 19.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 73.219999999999999 110.938 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.747 ' O ' HD13 ' A' ' 120' ' ' LEU . 88.2 m-70 -130.82 90.39 40.13 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.558 0.694 . . . . 61.530000000000001 110.876 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.558 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.4 Cg_endo -69.73 0.39 5.69 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.664 2.243 . . . . 63.340000000000003 112.289 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -113.93 -11.91 12.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.248 -0.433 . . . . 74.540000000000006 110.874 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.694 ' O ' HG23 ' A' ' 130' ' ' ILE . 6.7 tp -53.95 -47.87 70.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 71.219999999999999 110.892 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.772 HD13 HD11 ' A' ' 83' ' ' LEU . 2.0 pt? -51.0 -28.76 10.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 64.0 110.985 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.481 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.68 -27.21 23.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 73.409999999999997 110.892 179.9 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.403 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.1 pp20? -94.31 2.48 55.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.475 . . . . 71.439999999999998 110.839 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.694 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.5 pt -121.12 -33.99 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 75.140000000000001 111.174 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.774 ' HB3' HD12 ' A' ' 91' ' ' ILE . 2.3 ptt-85 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 65.420000000000002 110.911 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.579 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 4.6 mmt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.877 0.37 . . . . 71.030000000000001 110.916 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.77 -169.35 0.41 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 75.439999999999998 110.902 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 t -179.44 58.6 0.1 Allowed Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.572 0.701 . . . . 43.340000000000003 110.861 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 3.15 2.95 Favored 'Trans proline' 0 N--CA 1.465 -0.2 0 C-N-CA 122.72 2.28 . . . . 71.420000000000002 112.389 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.6 m -107.58 -45.71 7.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.199 -0.455 . . . . 73.209999999999994 111.077 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -106.92 -33.47 7.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 61.32 110.947 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.6 m-70 59.48 24.85 13.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.14 -0.482 . . . . 72.329999999999998 110.827 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -92.14 -67.22 0.87 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 75.219999999999999 110.991 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.74 -135.32 6.36 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.729 -0.748 . . . . 52.109999999999999 112.477 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.579 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 9.5 pt-20 -145.62 95.23 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.841 0.353 . . . . 70.420000000000002 110.913 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.537 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.5 OUTLIER -59.67 104.91 0.32 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.221 -0.445 . . . . 75.519999999999996 110.889 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 8.8 p -145.9 133.04 14.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.43 . . . . 64.129999999999995 111.145 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.537 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -49.25 132.75 19.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.178 -0.464 . . . . 73.310000000000002 110.868 -179.848 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.426 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 178.09 77.58 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.752 -0.737 . . . . 74.040000000000006 112.483 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.426 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -35.65 143.8 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.91 0.386 . . . . 74.439999999999998 111.094 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.31 -168.15 2.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.132 -0.485 . . . . 73.340000000000003 110.912 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -93.27 116.08 28.66 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.22 -0.445 . . . . 75.120000000000005 110.88 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.783 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.6 mm -107.68 91.35 7.24 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.654 0.74 . . . . 71.030000000000001 111.098 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.495 ' HB3' HG12 ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.8 105.1 1.43 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.716 2.277 . . . . 61.100000000000001 112.306 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -70.69 -29.64 66.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.993 0.425 . . . . 63.409999999999997 110.932 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.57 HG21 ' HG2' ' A' ' 25' ' ' ARG . 24.3 m -130.74 146.36 52.19 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.114 -0.493 . . . . 61.119999999999997 111.231 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -140.17 48.23 1.78 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 73.400000000000006 110.908 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.16 -69.03 0.57 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 71.450000000000003 110.847 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -134.56 -40.45 0.17 Allowed Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.746 -0.74 . . . . 64.209999999999994 112.428 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.57 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -102.95 39.61 1.52 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.901 0.381 . . . . 74.319999999999993 110.897 -179.84 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.414 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 11.1 tttt -49.33 109.65 0.29 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 73.319999999999993 110.86 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.597 HG21 ' CD1' ' A' ' 60' ' ' PHE . 2.2 t -128.08 92.27 3.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.275 -0.42 . . . . 73.420000000000002 111.127 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.495 HG12 ' HB3' ' A' ' 19' ' ' PRO . 0.8 OUTLIER -80.33 140.12 17.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 73.310000000000002 111.15 179.865 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.783 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -86.53 63.34 7.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 62.310000000000002 110.955 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.9 mttp -41.46 105.56 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 71.219999999999999 110.858 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.531 ' O ' HD13 ' A' ' 32' ' ' ILE . . . 115.5 62.1 0.37 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.653 -0.784 . . . . 72.209999999999994 112.398 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.598 HD11 ' CB ' ' A' ' 29' ' ' LEU . 19.4 mm -118.31 92.3 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.852 0.358 . . . . 61.5 111.151 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.12 153.25 39.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 61.350000000000001 110.827 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 168.22 -109.63 0.35 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.751 -0.738 . . . . 52.539999999999999 112.497 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.755 HD12 ' HB ' ' A' ' 44' ' ' ILE . 61.4 mt -156.82 85.81 0.97 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.89 0.376 . . . . 71.400000000000006 110.892 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.418 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -158.75 163.35 36.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.161 -0.472 . . . . 74.140000000000001 110.895 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -168.38 -47.27 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.068 -0.515 . . . . 73.400000000000006 110.93 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.404 HG22 ' HG2' ' A' ' 10' ' ' GLU . 4.2 m -120.54 -47.05 2.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 53.439999999999998 111.186 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -87.45 169.42 12.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.167 -0.469 . . . . 71.530000000000001 110.849 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.4 m -136.84 15.15 3.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 74.129999999999995 110.892 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -103.79 -62.88 1.25 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.157 -0.474 . . . . 54.200000000000003 110.925 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.447 ' HG3' ' HE3' ' A' ' 11' ' ' MET . 7.7 tp10 -77.14 61.91 2.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 65.019999999999996 110.891 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.3 p -98.03 155.64 17.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.491 . . . . 74.120000000000005 110.923 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.755 ' HB ' HD12 ' A' ' 35' ' ' LEU . 21.0 mm -141.84 140.45 30.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.466 . . . . 74.120000000000005 111.135 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.8 mtt -144.53 134.79 24.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 73.230000000000004 110.884 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.3 m-20 -81.93 -169.85 2.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 64.129999999999995 110.851 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.06 -60.1 4.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 53.329999999999998 110.934 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -51.76 -57.44 9.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.275 -0.42 . . . . 74.319999999999993 110.899 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.42 -58.75 5.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 70.329999999999998 110.912 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.9 t -53.74 -38.88 64.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 71.310000000000002 110.821 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.75 -43.99 97.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.096 -0.502 . . . . 72.140000000000001 110.904 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.83 -58.34 6.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 63.450000000000003 111.069 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -54.42 -47.3 72.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.257 -0.429 . . . . 75.510000000000005 110.869 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.82 -50.44 68.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.131 -0.486 . . . . 72.25 110.857 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.5 -41.2 60.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 62.539999999999999 111.107 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.741 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.7 OUTLIER -69.97 -66.99 0.52 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 50.130000000000003 110.946 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.43 HG12 HD21 ' A' ' 29' ' ' LEU . 18.1 m -47.82 -35.51 4.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 74.129999999999995 111.092 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -69.05 -54.43 15.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 73.219999999999999 110.87 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.62 -52.44 39.48 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 72.219999999999999 111.134 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.622 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -64.48 -44.69 90.23 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.449 . . . . 72.140000000000001 110.893 -179.975 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.0 mtt-85 -50.7 -51.63 47.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.158 -0.473 . . . . 72.019999999999996 110.933 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.69 -54.14 36.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 75.129999999999995 111.044 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.62 -38.58 32.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 54.299999999999997 110.878 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.622 HG23 ' O ' ' A' ' 60' ' ' PHE . 44.4 t -82.4 -25.99 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 72.400000000000006 111.121 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -22.98 67.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.159 -0.473 . . . . 74.219999999999999 110.867 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.48 -17.0 64.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 75.049999999999997 111.145 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -60.41 -20.2 58.81 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.125 -0.488 . . . . 75.409999999999997 110.901 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.758 HG22 HG13 ' A' ' 69' ' ' VAL . 92.8 m -158.51 -75.74 0.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 74.540000000000006 111.179 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.758 HG13 HG22 ' A' ' 68' ' ' THR . 17.6 m -148.62 -172.77 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 73.319999999999993 111.136 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -103.14 153.73 38.15 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.541 0.686 . . . . 43.119999999999997 111.021 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.528 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.2 Cg_endo -69.67 -7.69 21.68 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.685 2.257 . . . . 72.519999999999996 112.367 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -98.85 -36.31 9.83 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.201 -0.454 . . . . 71.530000000000001 110.852 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.564 ' O ' HG23 ' A' ' 77' ' ' VAL . 19.8 t80 -57.76 -61.13 2.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.194 -0.457 . . . . 71.329999999999998 110.896 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.77 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -40.01 -70.47 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 74.209999999999994 111.17 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.7 m -48.85 -38.87 10.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.151 -0.477 . . . . 71.120000000000005 111.205 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.6 mtmt -62.77 -39.05 92.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 74.409999999999997 110.802 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 73' ' ' PHE . 39.3 t -68.07 -38.07 79.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.268 -0.424 . . . . 74.5 111.121 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.423 ' HG3' ' O ' ' A' ' 74' ' ' ILE . 0.7 OUTLIER -70.33 -36.51 74.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 54.240000000000002 110.851 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -84.08 -20.84 31.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.169 -0.469 . . . . 74.109999999999999 110.895 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.462 ' HG2' HD23 ' A' ' 81' ' ' LEU . 5.5 ttmt -75.59 -50.19 16.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 71.230000000000004 110.87 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.816 ' HB2' HD23 ' A' ' 83' ' ' LEU . 12.9 mt -90.19 12.22 18.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 64.349999999999994 110.918 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.3 t 52.47 40.8 30.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 54.039999999999999 110.851 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.816 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.6 mm? -79.13 84.61 5.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 70.209999999999994 110.864 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.595 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.29 156.33 0.11 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 63.520000000000003 111.131 179.943 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -58.33 -24.7 60.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 75.239999999999995 110.9 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -77.08 -49.01 16.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 73.010000000000005 110.945 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.595 ' H ' HG23 ' A' ' 84' ' ' THR . 0.8 OUTLIER -68.98 -54.83 13.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.226 -0.443 . . . . 64.099999999999994 110.919 179.903 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.572 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -51.69 -35.35 42.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 73.150000000000006 111.104 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.2 m -78.67 -37.07 42.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 62.399999999999999 110.892 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -72.76 -24.79 61.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.128 -0.487 . . . . 63.229999999999997 110.82 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.717 ' CD1' HD12 ' A' ' 127' ' ' LEU . 51.9 mt -101.47 -64.09 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 61.130000000000003 111.112 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.54 ' HB3' HG23 ' A' ' 113' ' ' THR . 8.0 m-85 -71.72 -61.26 1.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 75.430000000000007 110.975 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.65 45.01 1.0 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.796 -0.716 . . . . 44.310000000000002 112.458 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -66.59 -46.62 74.9 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.751 -0.738 . . . . 41.520000000000003 112.564 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.49 172.54 21.45 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.717 -0.754 . . . . 71.530000000000001 112.5 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.675 HG13 ' H ' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -50.9 -66.64 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.869 0.366 . . . . 62.219999999999999 111.099 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.675 ' H ' HG13 ' A' ' 96' ' ' VAL . 9.0 t30 -86.24 42.23 0.98 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.155 -0.475 . . . . 71.140000000000001 110.882 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.13 -76.18 0.06 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 55.140000000000001 111.145 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -39.66 -40.32 0.89 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 75.239999999999995 110.866 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.9 m -59.93 -76.28 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.163 -0.471 . . . . 74.310000000000002 110.89 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.604 ' HB3' ' HB2' ' A' ' 107' ' ' ALA . 24.6 mtt85 -49.93 -45.66 51.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.102 -0.499 . . . . 64.230000000000004 110.885 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.491 ' HB3' HD12 ' A' ' 74' ' ' ILE . 10.4 m-85 -56.96 -36.57 70.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 64.349999999999994 110.943 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 -59.81 -25.98 65.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.104 -0.498 . . . . 74.530000000000001 110.891 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.11 -20.5 14.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 61.219999999999999 110.903 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.15 28.38 11.9 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.742 -0.742 . . . . 73.049999999999997 112.564 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -104.35 -8.65 19.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.819 0.342 . . . . 71.230000000000004 110.926 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.604 ' HB2' ' HB3' ' A' ' 101' ' ' ARG . . . -114.52 15.14 17.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 22.02 111.12 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.443 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 1.9 pt20 -127.04 54.6 12.63 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.529 0.68 . . . . 71.140000000000001 110.904 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.502 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.0 Cg_endo -69.75 37.03 0.24 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.642 2.228 . . . . 64.450000000000003 112.347 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.748 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.5 t-160 71.9 34.06 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.65 0.738 . . . . 74.340000000000003 110.856 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.748 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.4 Cg_endo -69.77 -164.07 0.12 Allowed 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.665 2.243 . . . . 74.129999999999995 112.412 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.94 -32.77 30.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.311 -0.404 . . . . 63.140000000000001 110.874 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.54 HG23 ' HB3' ' A' ' 92' ' ' PHE . 21.0 m -52.3 -55.35 21.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.476 . . . . 73.420000000000002 111.176 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.719 HG21 ' CG2' ' A' ' 68' ' ' THR . 42.7 mm -50.94 -46.55 30.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 62.530000000000001 111.116 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.442 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -62.52 -28.53 69.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 73.219999999999999 110.894 179.853 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.442 HD12 ' HG3' ' A' ' 115' ' ' LYS . 5.8 mp -81.29 -47.5 13.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.265 -0.425 . . . . 74.040000000000006 110.922 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.77 HD13 HG22 ' A' ' 74' ' ' ILE . 21.5 mt -55.91 -47.75 76.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.47 . . . . 65.230000000000004 110.995 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.614 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.0 ptp180 -54.91 -35.6 64.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 60.539999999999999 110.915 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.614 HG13 ' HG3' ' A' ' 118' ' ' ARG . 31.7 m -95.7 -3.46 10.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 73.219999999999999 111.145 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.747 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -89.68 -40.73 12.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 72.209999999999994 110.909 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -49.31 -32.43 11.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.256 -0.429 . . . . 72.409999999999997 110.849 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.47 -20.53 18.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 73.219999999999999 110.856 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.747 ' O ' HD13 ' A' ' 120' ' ' LEU . 48.0 m-70 -127.36 87.34 56.53 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.602 0.715 . . . . 61.530000000000001 110.865 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.602 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.6 Cg_endo -69.73 3.9 2.49 Favored 'Trans proline' 0 C--N 1.341 0.14 0 C-N-CA 122.747 2.298 . . . . 63.340000000000003 112.338 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -117.91 -12.42 10.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 74.540000000000006 110.897 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.557 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.7 tp -53.6 -48.09 69.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 71.219999999999999 110.958 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.717 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.8 pt? -46.33 -32.75 3.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 64.0 110.922 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -81.96 -38.08 25.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 73.409999999999997 110.927 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.551 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -78.72 -5.72 53.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.479 . . . . 71.439999999999998 110.892 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.557 HG23 ' O ' ' A' ' 126' ' ' LEU . 8.7 pt -118.14 -22.26 4.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.152 -0.476 . . . . 75.140000000000001 111.133 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.193 -0.458 . . . . 65.420000000000002 110.889 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mtt . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.838 0.352 . . . . 71.030000000000001 110.879 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.24 -171.21 0.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.192 -0.458 . . . . 75.439999999999998 110.906 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.403 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 0.5 OUTLIER 175.79 56.72 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.651 0.739 . . . . 43.340000000000003 110.96 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 53.3 Cg_endo -69.73 2.39 3.56 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.724 2.282 . . . . 71.420000000000002 112.327 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.596 HG23 ' HG3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -99.89 -44.6 11.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.448 . . . . 73.209999999999994 111.144 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 7' ' ' HIS . 0.1 OUTLIER -112.2 -40.01 4.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.169 -0.469 . . . . 61.32 110.894 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 24.6 m-70 69.29 51.63 0.5 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 72.329999999999998 110.854 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.31 -71.95 0.71 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 75.219999999999999 110.949 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -99.61 -121.38 4.6 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.669 -0.776 . . . . 52.109999999999999 112.556 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.504 ' O ' HG12 ' A' ' 12' ' ' VAL . 12.8 pt-20 -169.29 87.52 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.804 0.335 . . . . 70.420000000000002 110.938 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.522 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -46.04 105.71 0.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 75.519999999999996 110.869 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.504 HG12 ' O ' ' A' ' 10' ' ' GLU . 4.9 p -144.57 129.2 13.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 64.129999999999995 111.148 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.494 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.6 p -47.5 126.23 9.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 73.310000000000002 110.89 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.88 80.99 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.692 -0.766 . . . . 74.040000000000006 112.429 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.409 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.27 147.24 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.88 0.371 . . . . 74.439999999999998 111.097 -179.955 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.32 -165.32 1.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 73.340000000000003 110.899 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.656 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -96.54 117.34 30.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.262 -0.426 . . . . 75.120000000000005 110.851 179.914 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.724 ' O ' HD22 ' A' ' 29' ' ' LEU . 10.7 mm -108.05 91.3 7.68 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.639 0.733 . . . . 71.030000000000001 111.146 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.402 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.1 Cg_endo -69.7 96.26 0.58 Allowed 'Trans proline' 0 N--CA 1.464 -0.217 0 C-N-CA 122.754 2.302 . . . . 61.100000000000001 112.38 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.499 ' HB3' HG23 ' A' ' 27' ' ' THR . 14.2 t80 -64.29 -34.61 78.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 63.409999999999997 110.926 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.586 HG21 ' HG2' ' A' ' 25' ' ' ARG . 17.5 m -130.29 146.89 51.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 61.119999999999997 111.155 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -144.63 43.49 1.37 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 73.400000000000006 110.917 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.408 ' CD ' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -131.28 -39.64 1.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 71.450000000000003 110.802 -179.869 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -160.48 -53.23 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.736 -0.745 . . . . 64.209999999999994 112.495 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.586 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.75 42.44 1.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.867 0.365 . . . . 74.319999999999993 110.925 -179.897 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.402 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 15.1 tttm -49.77 117.47 2.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 73.319999999999993 110.893 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.499 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -128.91 91.04 3.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 73.420000000000002 111.08 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.656 HG11 ' HB2' ' A' ' 17' ' ' ASP . 43.0 t -76.62 126.7 37.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.232 -0.44 . . . . 73.310000000000002 111.132 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.73 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.77 51.78 2.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 62.310000000000002 110.913 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -38.59 107.47 0.07 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 71.219999999999999 110.922 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.24 46.09 0.38 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.755 -0.736 . . . . 72.209999999999994 112.5 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.566 HD11 ' HB3' ' A' ' 29' ' ' LEU . 13.4 mm -107.37 89.98 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.923 0.392 . . . . 61.5 111.146 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.33 156.43 38.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 61.350000000000001 110.875 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.13 -107.39 0.28 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.721 -0.752 . . . . 52.539999999999999 112.456 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.732 HD12 ' HB ' ' A' ' 44' ' ' ILE . 55.6 mt -156.27 82.47 0.99 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.896 0.379 . . . . 71.400000000000006 110.87 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.469 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -164.88 166.23 19.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.46 . . . . 74.140000000000001 110.91 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.5 -34.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 73.400000000000006 110.85 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.3 m -121.34 -45.28 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 53.439999999999998 111.087 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -98.94 176.02 5.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 71.530000000000001 110.856 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.5 p -141.25 28.81 1.84 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.205 -0.452 . . . . 74.129999999999995 110.85 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -110.49 -65.68 1.14 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.173 -0.467 . . . . 54.200000000000003 110.922 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.596 ' HG3' HG23 ' A' ' 5' ' ' VAL . 27.4 mm-40 -76.56 62.29 1.9 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 65.019999999999996 110.937 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.1 p -93.05 138.62 31.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 74.120000000000005 110.874 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.732 ' HB ' HD12 ' A' ' 35' ' ' LEU . 13.3 mm -135.71 138.91 47.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.086 -0.507 . . . . 74.120000000000005 111.115 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 15.2 mtt -139.3 143.19 37.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 73.230000000000004 110.854 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.6 m-20 -90.82 -168.91 2.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 64.129999999999995 110.844 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.17 -60.41 3.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.131 -0.486 . . . . 53.329999999999998 110.996 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.92 -58.24 7.61 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.139 -0.482 . . . . 74.319999999999993 110.9 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -50.5 -59.35 4.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 70.329999999999998 110.915 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.0 t -52.45 -42.91 64.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 71.310000000000002 110.78 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -57.38 -43.38 83.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.152 -0.476 . . . . 72.140000000000001 110.842 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.45 -61.93 1.82 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 63.450000000000003 111.113 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.477 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.7 t80 -52.56 -45.84 66.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.179 -0.464 . . . . 75.510000000000005 110.887 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.434 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -64.2 -50.41 68.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 72.25 110.842 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.21 -41.73 60.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.303 -0.408 . . . . 62.539999999999999 111.153 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.73 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -70.64 -66.99 0.53 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 50.130000000000003 110.93 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.477 HG13 ' O ' ' A' ' 53' ' ' PHE . 16.3 m -47.03 -35.64 3.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.257 -0.429 . . . . 74.129999999999995 111.094 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 11.0 mmmm -70.31 -51.91 26.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 73.219999999999999 110.939 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.4 -52.32 46.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.47 . . . . 72.219999999999999 111.14 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.644 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -65.29 -46.24 81.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 72.140000000000001 110.883 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -49.88 -52.49 32.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.104 -0.498 . . . . 72.019999999999996 110.866 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.82 -54.54 33.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 75.129999999999995 111.094 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.69 -42.05 33.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 54.299999999999997 110.836 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 60' ' ' PHE . 42.9 t -77.15 -28.49 16.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.164 -0.471 . . . . 72.400000000000006 111.142 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -20.62 59.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 74.219999999999999 110.853 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.69 -23.04 58.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 75.049999999999997 111.093 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -56.96 -75.18 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 75.409999999999997 110.933 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.759 HG22 HG13 ' A' ' 69' ' ' VAL . 93.6 m -149.39 -75.96 0.16 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 74.540000000000006 111.102 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.759 HG13 HG22 ' A' ' 68' ' ' THR . 17.0 m -149.59 -172.56 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.229 -0.441 . . . . 73.319999999999993 111.049 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.5 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -104.92 158.17 32.61 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.547 0.689 . . . . 43.119999999999997 111.075 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.5 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.8 Cg_endo -69.79 -8.15 22.88 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.604 2.202 . . . . 72.519999999999996 112.42 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -97.81 -34.87 10.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 71.530000000000001 110.797 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -57.5 -61.12 2.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.454 . . . . 71.329999999999998 110.9 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.867 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.82 -68.04 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 74.209999999999994 111.104 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -48.66 -38.88 10.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 71.120000000000005 111.177 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.8 mtmt -61.14 -45.5 94.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.456 . . . . 74.409999999999997 110.935 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.534 HG22 ' HB2' ' A' ' 121' ' ' ASP . 78.5 t -62.03 -39.48 83.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 74.5 111.112 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.465 HH22 HG21 ' A' ' 113' ' ' THR . 0.2 OUTLIER -63.64 -58.65 6.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 54.240000000000002 110.854 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -24.1 67.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 74.109999999999999 110.979 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.2 ttmt -67.97 -53.67 24.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 71.230000000000004 110.879 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.807 ' HB2' HD23 ' A' ' 83' ' ' LEU . 10.9 mt -90.68 12.79 17.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.192 -0.458 . . . . 64.349999999999994 110.947 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.3 t 53.5 38.41 28.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.117 -0.492 . . . . 54.039999999999999 110.915 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.807 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.8 mm? -79.58 87.04 5.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.127 -0.488 . . . . 70.209999999999994 110.943 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.637 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.55 157.4 0.1 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 63.520000000000003 111.115 179.976 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -57.55 -21.49 38.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 75.239999999999995 110.921 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -81.16 -49.21 11.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 73.010000000000005 110.957 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.637 ' H ' HG23 ' A' ' 84' ' ' THR . 21.9 tp10 -62.47 -54.31 42.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.448 . . . . 64.099999999999994 110.863 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.41 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -54.72 -35.8 64.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.483 . . . . 73.150000000000006 111.083 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 91.5 p -79.68 -26.11 41.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 62.399999999999999 110.832 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.93 -25.88 34.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.469 . . . . 63.229999999999997 110.873 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.734 HD12 ' HB3' ' A' ' 131' ' ' ARG . 24.5 mm -103.35 -59.05 3.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.157 -0.474 . . . . 61.130000000000003 111.17 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.581 ' HB3' HG23 ' A' ' 113' ' ' THR . 5.8 m-85 -75.77 -60.96 2.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 75.430000000000007 110.87 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.3 49.44 0.76 Allowed Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.711 -0.756 . . . . 44.310000000000002 112.527 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.79 -37.39 34.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 41.520000000000003 112.509 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.418 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 102.11 165.71 26.8 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.685 -0.769 . . . . 71.530000000000001 112.467 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.493 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.9 p -51.4 -50.67 27.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.832 0.348 . . . . 62.219999999999999 111.15 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.493 ' N ' HG13 ' A' ' 96' ' ' VAL . 14.2 p30 -86.93 37.73 0.77 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 71.140000000000001 110.928 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.418 ' HB2' ' O ' ' A' ' 95' ' ' GLY . . . -64.46 -76.43 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 55.140000000000001 111.11 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -43.25 -39.97 3.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 75.239999999999995 110.893 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.37 -75.38 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 74.310000000000002 110.876 -179.777 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.619 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 44.6 mtt180 -49.92 -45.02 50.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.075 -0.512 . . . . 64.230000000000004 110.892 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.723 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.0 m-85 -56.35 -37.54 70.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 64.349999999999994 110.909 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -53.35 -27.43 23.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.075 -0.511 . . . . 74.530000000000001 110.892 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.56 -22.2 12.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 61.219999999999999 110.9 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.23 28.16 9.43 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.77 -0.729 . . . . 73.049999999999997 112.48 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -100.36 -6.87 25.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.362 . . . . 71.230000000000004 110.915 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.619 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -109.74 10.68 24.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.189 -0.46 . . . . 22.02 111.101 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.45 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.9 pt20 -125.61 56.96 16.11 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.585 0.707 . . . . 71.140000000000001 110.96 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.532 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.8 Cg_endo -69.75 36.38 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.698 2.265 . . . . 64.450000000000003 112.317 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.773 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.6 t60 73.89 32.33 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.646 0.736 . . . . 74.340000000000003 110.865 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.773 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 52.9 Cg_endo -69.8 -163.98 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.721 2.281 . . . . 74.129999999999995 112.301 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.0 p -86.94 -28.95 22.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.235 -0.439 . . . . 63.140000000000001 110.87 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.583 HG22 HD12 ' A' ' 117' ' ' LEU . 22.0 m -53.5 -51.38 62.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.162 -0.472 . . . . 73.420000000000002 111.17 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.69 HG21 ' CG2' ' A' ' 68' ' ' THR . 38.9 mm -51.26 -42.52 26.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 62.530000000000001 111.105 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.537 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -67.44 -29.92 69.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.154 -0.475 . . . . 73.219999999999999 110.915 179.815 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.537 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.7 mp -79.23 -41.72 27.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.456 . . . . 74.040000000000006 110.922 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.867 HD13 HG22 ' A' ' 74' ' ' ILE . 13.8 mt -63.66 -49.51 72.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 65.230000000000004 110.902 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.58 ' HG3' HG13 ' A' ' 119' ' ' VAL . 14.5 ptp180 -52.07 -35.7 48.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 60.539999999999999 110.882 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.58 HG13 ' HG3' ' A' ' 118' ' ' ARG . 31.0 m -92.57 -14.07 8.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 73.219999999999999 111.099 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.768 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -77.04 -39.64 49.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.268 -0.424 . . . . 72.209999999999994 110.874 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.534 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.8 OUTLIER -50.44 -31.44 15.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.174 -0.466 . . . . 72.409999999999997 110.871 179.873 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -95.8 -19.86 19.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 73.219999999999999 110.966 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.768 ' O ' HD13 ' A' ' 120' ' ' LEU . 81.7 m-70 -131.41 90.07 38.92 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.589 0.709 . . . . 61.530000000000001 110.801 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.723 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.0 Cg_endo -69.71 0.13 6.05 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.745 2.297 . . . . 63.340000000000003 112.324 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -113.8 -11.95 12.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 74.540000000000006 110.882 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.68 ' O ' HG23 ' A' ' 130' ' ' ILE . 6.3 tp -53.6 -47.84 69.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.118 -0.492 . . . . 71.219999999999999 110.96 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.748 HD13 HD11 ' A' ' 83' ' ' LEU . 2.2 pt? -51.1 -29.0 11.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.12 -0.491 . . . . 64.0 110.968 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.487 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.67 -26.07 24.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.174 -0.466 . . . . 73.409999999999997 110.906 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.413 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.0 OUTLIER -95.88 3.31 53.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 71.439999999999998 110.917 179.943 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.68 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.8 pt -122.25 -34.52 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 75.140000000000001 111.093 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.734 ' HB3' HD12 ' A' ' 91' ' ' ILE . 1.3 ptt-85 . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 65.420000000000002 110.84 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mtt . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.884 0.374 . . . . 71.030000000000001 110.835 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.63 -169.53 0.43 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.429 . . . . 75.439999999999998 110.891 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.5 p 176.88 57.17 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.623 0.725 . . . . 43.340000000000003 110.875 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.79 0.52 5.55 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.715 2.277 . . . . 71.420000000000002 112.302 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 2.9 m -91.99 -40.37 12.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 73.209999999999994 111.2 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 7' ' ' HIS . 0.0 OUTLIER -122.9 -36.33 2.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 61.32 110.858 179.981 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 24.0 m-70 70.49 61.84 0.21 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 72.329999999999998 110.844 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.8 -77.15 0.57 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 75.219999999999999 110.96 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.402 ' HA3' ' HB3' ' A' ' 39' ' ' HIS . . . -94.43 -118.02 2.98 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.785 -0.722 . . . . 52.109999999999999 112.478 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.585 ' O ' HG12 ' A' ' 12' ' ' VAL . 8.2 pt-20 -177.45 96.57 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.905 0.383 . . . . 70.420000000000002 110.935 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.462 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -48.36 103.74 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 75.519999999999996 110.89 -179.974 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.585 HG12 ' O ' ' A' ' 10' ' ' GLU . 3.1 p -141.71 125.11 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 64.129999999999995 111.117 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.508 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.2 p -46.66 128.55 10.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.256 -0.429 . . . . 73.310000000000002 110.909 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.423 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . -179.7 79.94 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.722 -0.751 . . . . 74.040000000000006 112.47 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.423 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.42 146.16 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.905 0.383 . . . . 74.439999999999998 111.151 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.8 -166.3 1.96 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 73.340000000000003 110.906 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.636 ' HB2' HG11 ' A' ' 28' ' ' VAL . 1.4 p30 -94.63 119.73 33.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 75.120000000000005 110.825 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.712 ' O ' HD22 ' A' ' 29' ' ' LEU . 10.3 mm -110.78 92.15 13.97 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.596 0.713 . . . . 71.030000000000001 111.181 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.416 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.67 94.87 0.53 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.696 2.264 . . . . 61.100000000000001 112.369 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -60.75 -39.02 87.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 63.409999999999997 110.961 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.416 HG21 ' HG2' ' A' ' 25' ' ' ARG . 11.3 m -130.67 145.12 51.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.072 -0.513 . . . . 61.119999999999997 111.153 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 16.4 p90 -136.12 47.49 2.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.231 -0.44 . . . . 73.400000000000006 110.938 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.51 -68.58 0.57 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 71.450000000000003 110.89 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.07 -44.88 0.1 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.746 -0.74 . . . . 64.209999999999994 112.494 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.416 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -97.79 40.37 1.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.907 0.384 . . . . 74.319999999999993 110.92 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -53.92 124.22 14.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 73.319999999999993 110.9 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.403 ' O ' HG23 ' A' ' 27' ' ' THR . 1.7 t -139.2 94.46 2.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.142 -0.481 . . . . 73.420000000000002 111.131 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.636 HG11 ' HB2' ' A' ' 17' ' ' ASP . 45.1 t -76.8 127.4 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 73.310000000000002 111.151 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.764 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.86 51.57 2.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.172 -0.467 . . . . 62.310000000000002 110.916 179.956 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 29' ' ' LEU . 22.0 mttp -38.46 107.22 0.06 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 71.219999999999999 110.888 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.52 45.51 0.39 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.767 -0.73 . . . . 72.209999999999994 112.487 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.558 HD11 ' HB3' ' A' ' 29' ' ' LEU . 15.2 mm -106.3 91.38 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.854 0.359 . . . . 61.5 111.097 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.0 156.87 37.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 61.350000000000001 110.827 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.22 -106.89 0.28 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.79 -0.719 . . . . 52.539999999999999 112.518 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.753 HD12 ' HB ' ' A' ' 44' ' ' ILE . 50.3 mt -156.17 83.35 1.0 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.88 0.372 . . . . 71.400000000000006 110.845 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.534 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -167.97 161.69 12.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.489 . . . . 74.140000000000001 110.909 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.35 -33.61 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.161 -0.472 . . . . 73.400000000000006 110.886 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.402 HG11 ' HG2' ' A' ' 10' ' ' GLU . 4.5 p -118.93 -24.7 3.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 53.439999999999998 111.128 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.402 ' HB3' ' HA3' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -126.17 177.96 6.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.166 -0.47 . . . . 71.530000000000001 110.809 179.978 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.8 p -138.92 9.95 2.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 74.129999999999995 110.885 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -92.98 -66.04 0.95 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 54.200000000000003 110.901 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -75.71 60.92 1.33 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.49 . . . . 65.019999999999996 110.87 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.9 p -94.19 149.54 21.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.15 -0.477 . . . . 74.120000000000005 110.88 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.753 ' HB ' HD12 ' A' ' 35' ' ' LEU . 16.5 mm -144.1 137.95 24.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.481 . . . . 74.120000000000005 111.156 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.7 mtt -139.65 143.58 37.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.246 -0.434 . . . . 73.230000000000004 110.863 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -97.14 -168.55 1.72 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 64.129999999999995 110.853 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.48 -56.32 19.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.116 -0.493 . . . . 53.329999999999998 110.926 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -57.0 -58.3 8.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 74.319999999999993 110.928 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.68 -60.29 3.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.133 -0.485 . . . . 70.329999999999998 110.891 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.2 t -53.37 -39.41 64.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 71.310000000000002 110.856 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.69 -45.83 88.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.088 -0.505 . . . . 72.140000000000001 110.863 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.86 -59.16 4.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 63.450000000000003 111.089 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.455 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.1 t80 -53.3 -48.23 68.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.17 -0.468 . . . . 75.510000000000005 110.858 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.421 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.24 -48.72 77.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 72.25 110.914 179.959 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.5 -40.49 62.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 62.539999999999999 111.072 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.764 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.9 OUTLIER -71.09 -66.63 0.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.147 -0.478 . . . . 50.130000000000003 110.884 -179.885 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.2 m -47.6 -35.16 4.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.171 -0.468 . . . . 74.129999999999995 111.096 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -71.19 -52.04 21.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 73.219999999999999 110.918 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.47 -49.0 62.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.449 . . . . 72.219999999999999 111.129 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.618 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -67.0 -48.09 69.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 72.140000000000001 110.946 -179.965 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -49.67 -48.96 49.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 72.019999999999996 110.881 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.36 -55.88 13.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.491 . . . . 75.129999999999995 111.125 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.54 -40.88 39.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.21 -0.45 . . . . 54.299999999999997 110.84 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 60' ' ' PHE . 36.4 t -80.27 -25.28 11.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 72.400000000000006 111.15 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -21.24 66.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 74.219999999999999 110.901 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.91 -13.73 60.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 75.049999999999997 111.094 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -69.51 -12.0 61.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 75.409999999999997 110.829 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 43.3 m -127.35 -76.6 0.57 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 74.540000000000006 111.131 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.557 HG11 HG23 ' A' ' 74' ' ' ILE . 0.9 OUTLIER -147.76 141.55 19.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.171 -0.468 . . . . 73.319999999999993 111.081 179.985 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.609 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -81.76 161.14 62.18 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.552 0.691 . . . . 43.119999999999997 111.071 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.609 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.5 Cg_endo -69.76 -6.98 19.89 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.706 2.271 . . . . 72.519999999999996 112.311 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -99.82 -37.8 8.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 71.530000000000001 110.89 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -57.04 -62.17 1.94 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.143 -0.48 . . . . 71.329999999999998 110.879 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.7 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -43.73 -68.09 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 74.209999999999994 111.102 179.963 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.5 m -49.08 -39.1 11.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.111 -0.495 . . . . 71.120000000000005 111.092 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -61.42 -37.77 84.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 74.409999999999997 110.825 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.487 HG22 ' HB2' ' A' ' 121' ' ' ASP . 97.2 t -70.67 -38.39 72.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.274 -0.421 . . . . 74.5 111.127 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.9 OUTLIER -69.83 -33.22 72.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 54.240000000000002 110.899 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -89.75 -19.17 25.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 74.109999999999999 110.886 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.2 ttmm -75.85 -51.62 12.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.265 -0.425 . . . . 71.230000000000004 110.861 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.838 HD13 HD12 ' A' ' 120' ' ' LEU . 7.3 mt -91.49 14.47 14.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.245 -0.434 . . . . 64.349999999999994 110.922 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.02 43.19 29.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.439 . . . . 54.039999999999999 110.915 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.805 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.3 mm? -79.18 86.07 5.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.099 -0.5 . . . . 70.209999999999994 110.925 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.593 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -46.85 155.8 0.24 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 63.520000000000003 111.14 179.92 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.61 -22.24 61.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 75.239999999999995 110.991 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -77.34 -54.25 6.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 73.010000000000005 110.949 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.593 ' H ' HG23 ' A' ' 84' ' ' THR . 0.1 OUTLIER -65.5 -51.75 57.77 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.181 -0.463 . . . . 64.099999999999994 110.969 179.899 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.428 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -53.91 -32.68 54.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 73.150000000000006 111.021 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 13.7 t -80.34 -35.8 35.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 62.399999999999999 110.842 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -75.77 -21.13 57.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.088 -0.506 . . . . 63.229999999999997 110.896 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.728 ' CD1' HD12 ' A' ' 127' ' ' LEU . 55.7 mt -104.93 -62.35 2.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 61.130000000000003 111.112 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.54 ' HB3' HG23 ' A' ' 113' ' ' THR . 7.4 m-85 -75.31 -61.58 1.85 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 75.430000000000007 110.921 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 113.17 48.16 0.62 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.723 -0.751 . . . . 44.310000000000002 112.422 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.455 ' C ' ' HB2' ' A' ' 98' ' ' ALA . . . -69.78 -41.06 74.95 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.732 -0.747 . . . . 41.520000000000003 112.436 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 100.87 -155.85 19.27 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.76 -0.733 . . . . 71.530000000000001 112.533 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.5 t -80.56 -70.25 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 62.219999999999999 111.161 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -84.9 41.24 0.85 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.112 -0.494 . . . . 71.140000000000001 110.913 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.455 ' HB2' ' C ' ' A' ' 94' ' ' GLY . . . -61.61 -73.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 55.140000000000001 111.041 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -40.36 -41.68 1.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 75.239999999999995 110.871 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -60.1 -75.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 74.310000000000002 110.893 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.603 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 10.5 mtt180 -48.5 -47.9 38.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 64.230000000000004 110.886 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.572 ' HB3' HD12 ' A' ' 74' ' ' ILE . 10.5 m-85 -55.02 -37.78 67.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 64.349999999999994 110.943 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -53.3 -31.84 45.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 74.530000000000001 110.919 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.84 -20.5 14.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.116 -0.493 . . . . 61.219999999999999 110.909 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.63 25.41 13.58 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.731 -0.747 . . . . 73.049999999999997 112.541 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 28.4 m120 -98.38 -5.31 32.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.884 0.373 . . . . 71.230000000000004 110.909 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.603 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -118.02 17.17 14.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 22.02 111.093 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.448 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 1.9 pt20 -126.32 54.01 10.37 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.572 0.701 . . . . 71.140000000000001 110.948 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.506 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.2 Cg_endo -69.66 39.79 0.28 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.705 2.27 . . . . 64.450000000000003 112.34 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.736 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.3 m170 71.0 35.51 0.09 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.546 0.689 . . . . 74.340000000000003 110.898 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.736 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.2 Cg_endo -69.75 -164.05 0.12 Allowed 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.641 2.228 . . . . 74.129999999999995 112.353 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.501 ' O ' HD13 ' A' ' 116' ' ' LEU . 1.5 m -89.17 -23.84 22.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 63.140000000000001 110.831 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.54 HG23 ' HB3' ' A' ' 92' ' ' PHE . 21.1 m -61.49 -45.95 92.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.114 -0.494 . . . . 73.420000000000002 111.139 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 44.0 mm -56.35 -43.38 77.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 62.530000000000001 111.064 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.517 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -69.24 -33.75 73.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.142 -0.481 . . . . 73.219999999999999 110.873 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.712 ' HG ' HD12 ' A' ' 130' ' ' ILE . 7.5 mp -74.39 -38.12 63.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.235 -0.438 . . . . 74.040000000000006 110.918 179.874 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.7 HD13 HG22 ' A' ' 74' ' ' ILE . 33.7 mt -68.46 -51.42 43.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 65.230000000000004 110.974 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.559 ' HG3' HG13 ' A' ' 119' ' ' VAL . 14.7 ptp180 -50.33 -34.46 23.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 60.539999999999999 110.864 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.785 HG23 HD13 ' A' ' 126' ' ' LEU . 21.7 m -91.75 -19.98 6.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.224 -0.443 . . . . 73.219999999999999 111.085 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.838 HD12 HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -72.78 -44.58 61.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.171 -0.468 . . . . 72.209999999999994 110.92 179.963 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.487 ' HB2' HG22 ' A' ' 77' ' ' VAL . 9.9 t0 -48.54 -29.45 4.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 72.409999999999997 110.794 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -91.78 -30.16 16.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.465 . . . . 73.219999999999999 110.894 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.618 ' O ' HD13 ' A' ' 120' ' ' LEU . 19.1 m-70 -128.06 98.37 27.2 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.552 0.692 . . . . 61.530000000000001 110.857 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.535 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.4 Cg_endo -69.8 3.93 2.51 Favored 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.652 2.235 . . . . 63.340000000000003 112.357 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -115.2 -12.58 11.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.257 -0.429 . . . . 74.540000000000006 110.878 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.785 HD13 HG23 ' A' ' 119' ' ' VAL . 2.1 mt -50.42 -48.53 56.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 71.219999999999999 110.924 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.728 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.67 -29.47 7.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 64.0 110.978 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.476 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 6.9 m120 -86.85 -26.9 23.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 73.409999999999997 110.902 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.437 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.9 OUTLIER -96.89 7.81 45.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 71.439999999999998 110.885 -180.0 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.712 HD12 ' HG ' ' A' ' 116' ' ' LEU . 7.8 pt -128.06 -34.32 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 75.140000000000001 111.103 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.476 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 0.9 OUTLIER . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.253 -0.431 . . . . 65.420000000000002 110.858 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.594 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 1.4 mmt . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.893 0.378 . . . . 71.030000000000001 110.883 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.66 -169.2 0.41 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 75.439999999999998 110.893 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.1 p 177.64 58.39 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.641 0.734 . . . . 43.340000000000003 110.844 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 1.94 3.95 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.71 2.274 . . . . 71.420000000000002 112.348 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.604 HG21 ' CD ' ' A' ' 42' ' ' GLU . 23.8 m -92.78 -37.28 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 73.209999999999994 111.184 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -127.26 -33.46 2.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.155 -0.475 . . . . 61.32 110.88 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 66.4 57.67 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 72.329999999999998 110.806 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 93.4 mm-40 -121.3 -75.92 0.59 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.224 -0.444 . . . . 75.219999999999999 110.914 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -99.09 -114.74 3.55 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.682 -0.771 . . . . 52.109999999999999 112.477 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.594 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 7.6 pt-20 -174.3 98.07 0.1 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.803 0.335 . . . . 70.420000000000002 110.866 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.561 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -59.63 107.4 0.59 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.201 -0.454 . . . . 75.519999999999996 110.824 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 6.6 p -146.7 127.44 6.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 64.129999999999995 111.157 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.606 ' N ' HD23 ' A' ' 35' ' ' LEU . 5.8 p -48.61 135.81 14.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.449 . . . . 73.310000000000002 110.86 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.435 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 174.41 77.29 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.784 -0.722 . . . . 74.040000000000006 112.531 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.435 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.7 OUTLIER -33.71 141.35 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.897 0.379 . . . . 74.439999999999998 111.102 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.17 -168.14 2.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.441 . . . . 73.340000000000003 110.939 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -93.2 116.25 28.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.271 -0.422 . . . . 75.120000000000005 110.913 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.78 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.6 mm -107.91 91.27 7.44 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.653 0.739 . . . . 71.030000000000001 111.058 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.477 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 54.4 Cg_endo -69.71 103.85 1.22 Allowed 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.688 2.258 . . . . 61.100000000000001 112.379 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -68.72 -34.2 75.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 63.409999999999997 110.926 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.529 HG21 ' HG2' ' A' ' 25' ' ' ARG . 27.5 m -128.05 147.37 50.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.107 -0.497 . . . . 61.119999999999997 111.077 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -141.62 47.78 1.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 73.400000000000006 110.91 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.18 -68.7 0.55 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.116 -0.493 . . . . 71.450000000000003 110.863 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -132.32 -42.92 0.17 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.708 -0.758 . . . . 64.209999999999994 112.404 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.529 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -102.05 40.46 1.33 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.842 0.353 . . . . 74.319999999999993 110.87 -179.803 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.41 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 8.7 tttm -50.08 113.9 0.97 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 73.319999999999993 110.91 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.577 HG21 ' CD2' ' A' ' 60' ' ' PHE . 2.1 t -134.65 94.76 3.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 73.420000000000002 111.151 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.477 ' HA ' ' HA ' ' A' ' 19' ' ' PRO . 0.8 OUTLIER -82.15 140.29 16.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 73.310000000000002 111.122 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.78 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -86.46 63.32 7.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 62.310000000000002 110.983 179.929 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -41.6 105.22 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 71.219999999999999 110.852 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.522 ' O ' HD13 ' A' ' 32' ' ' ILE . . . 115.37 62.46 0.37 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.737 -0.744 . . . . 72.209999999999994 112.516 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.618 HD11 ' CB ' ' A' ' 29' ' ' LEU . 19.9 mm -118.05 93.3 2.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.827 0.346 . . . . 61.5 111.147 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.81 152.3 38.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 61.350000000000001 110.907 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.58 -109.42 0.34 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.689 -0.767 . . . . 52.539999999999999 112.46 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.741 HD12 ' HB ' ' A' ' 44' ' ' ILE . 51.6 mt -156.76 86.31 0.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.805 0.336 . . . . 71.400000000000006 110.881 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.47 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.77 159.85 30.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 74.140000000000001 110.922 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 32.3 t -164.05 -46.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.088 -0.505 . . . . 73.400000000000006 110.92 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.0 m -120.37 -47.05 2.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.198 -0.455 . . . . 53.439999999999998 111.105 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -87.96 171.45 10.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 71.530000000000001 110.811 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -137.64 9.99 2.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.218 -0.446 . . . . 74.129999999999995 110.878 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -99.24 -62.73 1.2 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 54.200000000000003 110.89 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.604 ' CD ' HG21 ' A' ' 5' ' ' VAL . 14.4 tp10 -76.95 61.56 1.97 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 65.019999999999996 110.866 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.1 p -99.54 158.94 15.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 74.120000000000005 110.835 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.741 ' HB ' HD12 ' A' ' 35' ' ' LEU . 22.8 mm -140.95 139.75 33.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.153 -0.476 . . . . 74.120000000000005 111.17 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.7 mtm -145.87 131.82 19.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 73.230000000000004 110.902 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 44.0 m-20 -84.06 -169.78 2.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 64.129999999999995 110.857 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.19 -58.24 8.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 53.329999999999998 110.873 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.1 -55.8 24.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.191 -0.459 . . . . 74.319999999999993 110.867 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.47 -58.97 4.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 70.329999999999998 110.87 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.3 t -55.42 -38.41 68.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.15 -0.477 . . . . 71.310000000000002 110.826 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.09 -45.81 89.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 72.140000000000001 110.821 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.3 -58.12 6.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 63.450000000000003 111.159 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -54.02 -46.88 71.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 75.510000000000005 110.892 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.411 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -64.67 -50.52 66.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.125 -0.489 . . . . 72.25 110.883 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.39 -39.63 57.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.255 -0.43 . . . . 62.539999999999999 111.128 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.754 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -71.94 -67.56 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.248 -0.433 . . . . 50.130000000000003 110.847 -179.893 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.467 HG23 ' N ' ' A' ' 58' ' ' LYS . 21.9 m -46.77 -41.88 5.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 74.129999999999995 111.148 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.467 ' N ' HG23 ' A' ' 57' ' ' VAL . 10.0 mmmm -65.94 -50.83 62.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.246 -0.433 . . . . 73.219999999999999 110.89 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.43 -52.28 39.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 72.219999999999999 111.128 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.611 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -66.45 -42.67 87.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 72.140000000000001 110.869 -179.9 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 31.4 mtp85 -50.09 -52.98 30.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.154 -0.475 . . . . 72.019999999999996 110.892 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.26 -53.79 32.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 75.129999999999995 111.138 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.0 -39.48 26.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.293 -0.412 . . . . 54.299999999999997 110.813 -179.805 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 60' ' ' PHE . 60.3 t -80.7 -28.13 11.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 72.400000000000006 111.088 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -19.58 48.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 74.219999999999999 110.877 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.35 -23.35 36.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.191 -0.459 . . . . 75.049999999999997 111.099 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -51.78 -74.85 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 75.409999999999997 110.871 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.791 HG22 HG13 ' A' ' 69' ' ' VAL . 92.9 m -118.52 -75.63 0.58 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 74.540000000000006 111.154 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.791 HG13 HG22 ' A' ' 68' ' ' THR . 16.5 m -149.2 -172.37 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 73.319999999999993 111.128 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.559 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -105.57 159.75 28.43 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.653 0.74 . . . . 43.119999999999997 111.162 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.559 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.3 Cg_endo -69.76 -8.12 22.8 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.699 2.266 . . . . 72.519999999999996 112.356 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -97.69 -35.33 10.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 71.530000000000001 110.853 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -57.43 -60.02 4.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 71.329999999999998 110.874 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.895 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -45.74 -68.41 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.18 -0.463 . . . . 74.209999999999994 111.124 -179.965 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -48.2 -39.51 9.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.435 . . . . 71.120000000000005 111.166 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -60.18 -47.51 85.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.438 . . . . 74.409999999999997 110.875 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.562 HG22 ' HB2' ' A' ' 121' ' ' ASP . 95.0 t -60.49 -38.82 79.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 74.5 111.168 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.528 HH22 HG21 ' A' ' 113' ' ' THR . 0.4 OUTLIER -63.66 -60.05 3.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 54.240000000000002 110.939 -179.991 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.31 -21.22 66.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.475 . . . . 74.109999999999999 110.899 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -70.32 -54.2 13.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.267 -0.424 . . . . 71.230000000000004 110.918 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.816 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.1 mt -91.29 14.84 13.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 64.349999999999994 110.931 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 30.5 m 53.89 37.52 26.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.159 -0.473 . . . . 54.039999999999999 110.869 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.816 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.8 mm? -79.69 83.82 5.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 70.209999999999994 110.912 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.604 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.19 157.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 63.520000000000003 111.137 179.906 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -56.45 -23.13 36.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.219 -0.446 . . . . 75.239999999999995 110.885 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.63 -48.54 13.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 73.010000000000005 110.916 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.604 ' H ' HG23 ' A' ' 84' ' ' THR . 43.4 tt0 -61.63 -55.72 27.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.218 -0.447 . . . . 64.099999999999994 110.892 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.428 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -49.15 -32.45 10.1 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.184 -0.462 . . . . 73.150000000000006 111.087 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 5.6 p -80.54 -35.19 34.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 62.399999999999999 110.86 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -73.09 -23.7 60.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.084 -0.507 . . . . 63.229999999999997 110.846 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.77 HG23 ' HB3' ' A' ' 131' ' ' ARG . 19.3 mm -105.19 -63.02 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 61.130000000000003 111.09 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.576 ' HB3' HG23 ' A' ' 113' ' ' THR . 3.8 m-85 -74.62 -64.36 1.05 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.228 -0.442 . . . . 75.430000000000007 110.911 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 116.78 47.56 0.48 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.706 -0.759 . . . . 44.310000000000002 112.459 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -67.42 -35.34 87.01 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.768 -0.73 . . . . 41.520000000000003 112.443 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.31 -119.4 5.67 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.756 -0.735 . . . . 71.530000000000001 112.541 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 97' ' ' ASN . 0.1 OUTLIER -120.46 -61.57 2.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.859 0.362 . . . . 62.219999999999999 111.056 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.48 ' N ' HG22 ' A' ' 96' ' ' VAL . 1.0 OUTLIER -86.15 43.97 1.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.198 -0.455 . . . . 71.140000000000001 110.912 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.29 -75.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.144 -0.48 . . . . 55.140000000000001 111.125 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -41.81 -39.88 1.89 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 75.239999999999995 110.837 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.2 m -59.95 -76.22 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.116 -0.493 . . . . 74.310000000000002 110.836 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.622 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 30.1 mtt180 -50.34 -44.66 54.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 64.230000000000004 110.884 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.725 ' HB3' HD12 ' A' ' 74' ' ' ILE . 8.2 m-85 -55.86 -37.21 68.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 64.349999999999994 110.937 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -51.8 -29.26 18.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.1 -0.5 . . . . 74.530000000000001 110.867 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -107.16 -22.25 12.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 61.219999999999999 110.922 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.39 27.0 9.53 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.664 -0.779 . . . . 73.049999999999997 112.462 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 -98.34 -6.64 30.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.842 0.353 . . . . 71.230000000000004 110.843 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.622 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -110.51 10.57 23.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 22.02 111.123 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.45 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.9 pt20 -124.19 57.2 13.02 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.579 0.704 . . . . 71.140000000000001 110.91 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.523 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.9 Cg_endo -69.74 35.87 0.22 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.635 2.223 . . . . 64.450000000000003 112.408 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.762 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER 73.67 32.56 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.634 0.731 . . . . 74.340000000000003 110.894 179.934 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.762 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.0 Cg_endo -69.72 -164.02 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.721 2.28 . . . . 74.129999999999995 112.351 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.32 -30.95 21.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.473 . . . . 63.140000000000001 110.852 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.739 HG22 ' CD1' ' A' ' 117' ' ' LEU . 74.7 m -53.48 -48.08 69.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 73.420000000000002 111.101 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.694 HG21 ' CG2' ' A' ' 68' ' ' THR . 40.2 mm -55.19 -46.27 77.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.45 . . . . 62.530000000000001 111.189 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.505 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -63.39 -29.14 70.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.149 -0.478 . . . . 73.219999999999999 110.894 179.831 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.549 ' CD2' HD12 ' A' ' 130' ' ' ILE . 6.4 mp -79.69 -42.45 24.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.203 -0.453 . . . . 74.040000000000006 110.862 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.895 HD13 HG22 ' A' ' 74' ' ' ILE . 3.8 mt -61.19 -49.71 76.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.451 . . . . 65.230000000000004 110.863 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.558 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.3 ptp180 -52.85 -37.22 59.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 60.539999999999999 110.859 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.558 HG13 ' HG3' ' A' ' 118' ' ' ARG . 32.8 m -90.87 -11.35 9.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.222 -0.445 . . . . 73.219999999999999 111.108 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.743 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -81.71 -40.23 23.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 72.209999999999994 110.912 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.562 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.5 OUTLIER -50.44 -30.23 12.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 72.409999999999997 110.872 179.864 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -98.09 -19.26 18.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 73.219999999999999 110.876 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.743 ' O ' HD13 ' A' ' 120' ' ' LEU . 57.1 m-70 -129.64 88.89 48.35 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.607 0.718 . . . . 61.530000000000001 110.917 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.692 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.7 Cg_endo -69.75 2.17 3.77 Favored 'Trans proline' 0 N--CA 1.466 -0.13 0 C-N-CA 122.68 2.253 . . . . 63.340000000000003 112.351 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -115.75 -12.59 11.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 74.540000000000006 110.872 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.658 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.7 tp -54.26 -46.46 72.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 71.219999999999999 110.892 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.442 ' HB3' HD11 ' A' ' 120' ' ' LEU . 0.9 OUTLIER -48.61 -30.62 5.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.165 -0.47 . . . . 64.0 110.896 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.62 HD21 HH12 ' A' ' 131' ' ' ARG . 6.4 m120 -85.19 -31.06 23.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 73.409999999999997 110.889 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.424 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.9 OUTLIER -89.75 4.41 49.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 71.439999999999998 110.86 -179.948 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.658 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.8 pt -123.63 -34.84 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.477 . . . . 75.140000000000001 111.157 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.77 ' HB3' HG23 ' A' ' 91' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 65.420000000000002 110.873 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.446 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.85 0.357 . . . . 71.030000000000001 110.895 . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.43 -169.71 0.46 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.261 -0.427 . . . . 75.439999999999998 110.871 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.417 ' O ' ' N ' ' A' ' 7' ' ' HIS . 1.9 p 176.7 59.42 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.61 0.719 . . . . 43.340000000000003 110.937 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.7 1.74 4.13 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.664 2.242 . . . . 71.420000000000002 112.371 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.596 HG21 ' CD ' ' A' ' 42' ' ' GLU . 22.8 m -92.93 -37.35 8.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 73.209999999999994 111.148 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -127.0 -33.52 2.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 61.32 110.878 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.417 ' N ' ' O ' ' A' ' 3' ' ' CYS . 15.9 m-70 66.6 57.56 0.68 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.23 -0.441 . . . . 72.329999999999998 110.84 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -123.49 -75.78 0.6 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.278 -0.419 . . . . 75.219999999999999 110.869 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.56 -116.05 3.02 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.783 -0.722 . . . . 52.109999999999999 112.484 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.446 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 8.0 pt-20 -176.65 94.82 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.768 0.318 . . . . 70.420000000000002 110.929 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.597 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.3 ptp -54.62 106.19 0.2 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 75.519999999999996 110.809 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.442 HG12 ' O ' ' A' ' 10' ' ' GLU . 4.2 p -143.27 124.44 10.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 64.129999999999995 111.128 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.614 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.1 p -48.75 132.05 17.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 73.310000000000002 110.897 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.409 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.98 81.93 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.763 -0.732 . . . . 74.040000000000006 112.516 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.414 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -36.88 146.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.848 0.356 . . . . 74.439999999999998 111.154 -179.933 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.86 -165.51 1.65 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.183 -0.462 . . . . 73.340000000000003 110.94 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.682 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -95.19 116.76 29.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 75.120000000000005 110.871 179.841 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.718 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.1 mm -107.52 92.89 9.07 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.687 0.756 . . . . 71.030000000000001 111.112 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.411 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.4 Cg_endo -69.85 97.1 0.63 Allowed 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.651 2.234 . . . . 61.100000000000001 112.343 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.432 ' HB3' HG23 ' A' ' 27' ' ' THR . 18.5 t80 -62.94 -38.54 91.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 63.409999999999997 110.899 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.478 HG21 ' HG2' ' A' ' 25' ' ' ARG . 17.0 m -128.91 144.53 51.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 61.119999999999997 111.167 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -133.89 43.43 2.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.282 -0.417 . . . . 73.400000000000006 110.916 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.47 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -129.28 -68.38 0.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.154 -0.476 . . . . 71.450000000000003 110.884 -179.907 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -136.53 -46.04 0.08 OUTLIER Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.674 -0.774 . . . . 64.209999999999994 112.47 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.478 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.32 39.77 1.09 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.857 0.361 . . . . 74.319999999999993 110.885 -179.895 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.401 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 12.7 tttt -52.32 115.42 1.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 73.319999999999993 110.931 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.432 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -129.06 93.32 3.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.261 -0.427 . . . . 73.420000000000002 111.13 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.682 HG11 ' HB2' ' A' ' 17' ' ' ASP . 46.4 t -76.63 127.53 37.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.449 . . . . 73.310000000000002 111.117 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.741 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.71 51.22 2.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 62.310000000000002 110.95 179.945 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.2 mttp -37.74 107.64 0.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 71.219999999999999 110.88 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.67 47.46 0.4 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.791 -0.718 . . . . 72.209999999999994 112.497 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.58 HD11 ' HB3' ' A' ' 29' ' ' LEU . 16.7 mm -107.93 92.12 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.799 0.333 . . . . 61.5 111.2 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.05 154.07 38.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.456 . . . . 61.350000000000001 110.868 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.25 -107.8 0.29 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.708 -0.758 . . . . 52.539999999999999 112.493 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.757 HD12 ' HB ' ' A' ' 44' ' ' ILE . 45.1 mt -156.99 87.23 0.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.743 0.306 . . . . 71.400000000000006 110.856 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.434 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -162.62 159.47 24.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.195 -0.457 . . . . 74.140000000000001 110.929 179.941 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 36.1 t -168.56 -38.86 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.078 -0.51 . . . . 73.400000000000006 110.881 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.404 HG13 ' N ' ' A' ' 39' ' ' HIS . 2.5 p -124.05 -47.02 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 53.439999999999998 111.146 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.404 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -91.1 171.76 9.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 71.530000000000001 110.891 179.924 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.8 p -137.3 9.58 2.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 74.129999999999995 110.831 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -100.38 -62.67 1.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 54.200000000000003 110.926 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.596 ' CD ' HG21 ' A' ' 5' ' ' VAL . 13.4 tp10 -76.73 61.68 1.89 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 65.019999999999996 110.865 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.4 p -99.08 159.5 14.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 74.120000000000005 110.881 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.757 ' HB ' HD12 ' A' ' 35' ' ' LEU . 21.3 mm -143.85 140.06 25.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 74.120000000000005 111.121 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.7 mtt -143.27 135.11 26.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.439 . . . . 73.230000000000004 110.859 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -86.89 -169.5 2.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.187 -0.46 . . . . 64.129999999999995 110.921 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.83 -60.87 2.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.166 -0.47 . . . . 53.329999999999998 110.961 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -52.29 -57.07 10.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 74.319999999999993 110.843 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -50.84 -58.98 4.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 70.329999999999998 110.894 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.8 t -53.89 -40.97 67.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 71.310000000000002 110.865 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.93 -44.73 87.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.148 -0.478 . . . . 72.140000000000001 110.889 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.72 -60.45 3.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.456 . . . . 63.450000000000003 111.034 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.436 ' CZ ' HG11 ' A' ' 57' ' ' VAL . 20.6 t80 -53.56 -47.51 69.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 75.510000000000005 110.936 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.43 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.75 -48.36 79.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 72.25 110.874 179.925 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.45 -42.9 64.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 62.539999999999999 111.01 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.741 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -69.55 -66.16 0.62 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 50.130000000000003 110.968 -179.905 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.436 HG11 ' CZ ' ' A' ' 53' ' ' PHE . 17.9 m -47.3 -35.94 3.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.241 -0.436 . . . . 74.129999999999995 111.083 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 mmmt -69.79 -51.32 34.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.201 -0.454 . . . . 73.219999999999999 110.865 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.97 -52.04 53.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.447 . . . . 72.219999999999999 111.163 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.635 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.2 OUTLIER -65.41 -46.1 81.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 72.140000000000001 110.863 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.93 -52.39 33.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.107 -0.497 . . . . 72.019999999999996 110.85 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.87 -54.41 35.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 75.129999999999995 111.119 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.06 -41.19 34.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.221 -0.445 . . . . 54.299999999999997 110.867 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 60' ' ' PHE . 41.9 t -78.86 -27.15 13.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.081 -0.509 . . . . 72.400000000000006 111.096 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.2 -19.24 62.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 74.219999999999999 110.915 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.84 -20.05 66.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.501 . . . . 75.049999999999997 111.119 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -58.7 172.49 0.51 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 75.409999999999997 110.912 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.931 HG22 HG13 ' A' ' 69' ' ' VAL . 99.2 m -51.77 -77.38 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.143 -0.481 . . . . 74.540000000000006 111.14 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.931 HG13 HG22 ' A' ' 68' ' ' THR . 19.1 m -137.77 -174.01 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 73.319999999999993 111.127 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.509 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -104.22 158.18 32.47 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.639 0.733 . . . . 43.119999999999997 111.091 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.564 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.6 Cg_endo -69.7 -7.46 21.09 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.668 2.245 . . . . 72.519999999999996 112.377 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -96.43 -39.1 9.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.158 -0.473 . . . . 71.530000000000001 110.943 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.429 ' CE1' ' HA ' ' A' ' 118' ' ' ARG . 11.8 t80 -55.31 -60.2 3.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.106 -0.497 . . . . 71.329999999999998 110.854 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.623 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -45.67 -69.72 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 74.209999999999994 111.15 -179.999 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.1 m -47.76 -38.01 6.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.129 -0.487 . . . . 71.120000000000005 111.151 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.1 mtmt -61.47 -45.79 92.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 74.409999999999997 110.886 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.626 HG22 ' HB2' ' A' ' 121' ' ' ASP . 69.5 t -61.93 -38.33 80.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 74.5 111.091 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.438 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -65.25 -56.61 11.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.28 -0.418 . . . . 54.240000000000002 110.822 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.6 pttt -67.17 -21.24 65.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.253 -0.431 . . . . 74.109999999999999 110.912 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -71.39 -53.24 14.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 71.230000000000004 110.871 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.836 ' HB2' HD23 ' A' ' 83' ' ' LEU . 14.1 mt -91.63 14.99 13.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.238 -0.437 . . . . 64.349999999999994 110.943 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.3 m 51.54 38.18 21.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 54.039999999999999 110.85 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.836 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.9 mm? -79.28 86.75 5.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 70.209999999999994 110.827 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.645 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.18 155.92 0.18 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 63.520000000000003 111.097 179.905 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -58.34 -21.65 50.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.173 -0.467 . . . . 75.239999999999995 110.91 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -80.68 -53.72 6.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 73.010000000000005 110.855 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.645 ' H ' HG23 ' A' ' 84' ' ' THR . 0.5 OUTLIER -63.08 -47.69 81.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 64.099999999999994 110.881 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.414 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -56.5 -32.53 65.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.119 -0.491 . . . . 73.150000000000006 111.028 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 26.3 p -80.57 -33.98 35.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.305 -0.407 . . . . 62.399999999999999 110.808 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -74.3 -25.7 59.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 63.229999999999997 110.881 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.726 ' CD1' HD12 ' A' ' 127' ' ' LEU . 49.7 mt -101.43 -59.76 3.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 61.130000000000003 111.132 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.551 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.7 m-85 -77.99 -62.86 1.54 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 75.430000000000007 110.86 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 111.98 50.39 0.59 Allowed Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.77 -0.728 . . . . 44.310000000000002 112.538 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -82.12 -44.61 7.49 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.772 -0.728 . . . . 41.520000000000003 112.525 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 109.96 167.33 19.82 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.724 -0.75 . . . . 71.530000000000001 112.461 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.502 HG13 ' N ' ' A' ' 97' ' ' ASN . 3.4 p -56.67 -50.62 73.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.845 0.355 . . . . 62.219999999999999 111.124 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.502 ' N ' HG13 ' A' ' 96' ' ' VAL . 12.0 p30 -86.18 33.99 0.62 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 71.140000000000001 110.934 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.407 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -64.26 -77.17 0.06 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 55.140000000000001 111.114 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.407 ' C ' ' O ' ' A' ' 98' ' ' ALA . 47.9 m-85 -37.75 -47.11 0.97 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 75.239999999999995 110.854 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.08 -75.39 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.149 -0.478 . . . . 74.310000000000002 110.916 -179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.548 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 17.2 mtt180 -46.82 -53.64 11.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.093 -0.503 . . . . 64.230000000000004 110.865 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.622 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.7 m-85 -49.6 -39.41 35.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 64.349999999999994 110.929 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -51.81 -40.55 60.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.114 -0.494 . . . . 74.530000000000001 110.913 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.18 -18.8 22.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.111 -0.495 . . . . 61.219999999999999 110.942 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.33 25.88 13.22 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.726 -0.749 . . . . 73.049999999999997 112.492 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -92.82 -28.65 16.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.847 0.356 . . . . 71.230000000000004 110.926 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.548 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -98.13 18.86 15.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 22.02 111.083 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.498 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -121.01 53.87 3.65 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.607 0.718 . . . . 71.140000000000001 110.913 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.5 Cg_endo -69.75 27.06 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.652 2.235 . . . . 64.450000000000003 112.374 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.731 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.8 m-70 70.87 36.02 0.1 Allowed Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 121.649 0.738 . . . . 74.340000000000003 110.919 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.731 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.3 Cg_endo -69.74 -165.28 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.608 2.205 . . . . 74.129999999999995 112.363 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 12.9 p -82.56 -32.72 28.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 63.140000000000001 110.882 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.551 HG23 ' HB3' ' A' ' 92' ' ' PHE . 17.3 m -49.02 -42.73 39.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 73.420000000000002 111.068 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.442 HD11 ' HG2' ' A' ' 108' ' ' GLN . 24.4 mm -60.76 -43.5 95.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.253 -0.431 . . . . 62.530000000000001 111.13 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.695 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -63.33 -29.67 70.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 73.219999999999999 110.929 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.695 HD12 ' HG3' ' A' ' 115' ' ' LYS . 8.1 mp -81.49 -47.61 12.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.236 -0.438 . . . . 74.040000000000006 110.9 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.623 HD13 HG22 ' A' ' 74' ' ' ILE . 34.9 mt -56.39 -47.81 78.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.448 . . . . 65.230000000000004 110.926 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.66 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.3 ptp180 -55.18 -36.09 65.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 60.539999999999999 110.815 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.66 HG13 ' HG3' ' A' ' 118' ' ' ARG . 19.9 m -95.91 0.22 10.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.287 -0.415 . . . . 73.219999999999999 111.15 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.754 HD12 HD13 ' A' ' 81' ' ' LEU . 0.5 OUTLIER -92.21 -38.29 12.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.105 -0.498 . . . . 72.209999999999994 110.915 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.626 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.3 OUTLIER -52.45 -24.4 7.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 72.409999999999997 110.844 179.841 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.502 ' HD3' ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -100.66 -20.37 15.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.244 -0.434 . . . . 73.219999999999999 110.942 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.732 ' O ' HD13 ' A' ' 120' ' ' LEU . 41.7 m80 -130.19 91.05 40.11 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.547 0.689 . . . . 61.530000000000001 110.935 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.673 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.8 Cg_endo -69.69 2.05 3.84 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.658 2.238 . . . . 63.340000000000003 112.326 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -116.45 -12.17 11.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.439 . . . . 74.540000000000006 110.924 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.653 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.8 tp -52.9 -47.4 67.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 71.219999999999999 110.955 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.726 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.8 pt? -49.7 -29.52 7.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.132 -0.485 . . . . 64.0 110.901 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.516 HD21 HH12 ' A' ' 131' ' ' ARG . 6.8 m120 -86.08 -28.41 24.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.46 . . . . 73.409999999999997 110.855 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.433 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -93.71 5.36 51.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 71.439999999999998 110.936 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.653 HG23 ' O ' ' A' ' 126' ' ' LEU . 11.4 pt -124.8 -35.18 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 75.140000000000001 111.145 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.516 HH12 HD21 ' A' ' 128' ' ' ASN . 1.6 ptt-85 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 65.420000000000002 110.859 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mmt . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.817 0.341 . . . . 71.030000000000001 110.852 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.34 -169.14 0.43 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 75.439999999999998 110.926 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.0 p -179.83 59.7 0.1 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.611 0.72 . . . . 43.340000000000003 110.925 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -4.51 14.18 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.684 2.256 . . . . 71.420000000000002 112.332 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.543 HG12 ' N ' ' A' ' 6' ' ' CYS . 2.1 t -74.43 -62.17 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 73.209999999999994 111.14 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.543 ' N ' HG12 ' A' ' 5' ' ' VAL . 49.4 t -120.14 -18.58 8.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 61.32 110.861 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 63.65 79.88 0.25 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.252 -0.431 . . . . 72.329999999999998 110.848 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -138.52 -75.49 0.38 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 75.219999999999999 110.952 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.636 ' HA3' HG13 ' A' ' 38' ' ' VAL . . . -98.05 -114.27 3.32 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.678 -0.773 . . . . 52.109999999999999 112.481 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.46 ' HG2' HG11 ' A' ' 38' ' ' VAL . 5.7 pt-20 -170.62 93.94 0.2 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.801 0.334 . . . . 70.420000000000002 110.945 -179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.564 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.7 OUTLIER -54.18 98.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 75.519999999999996 110.874 -179.934 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 15.0 p -144.32 131.02 16.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 64.129999999999995 111.087 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.515 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.3 OUTLIER -44.91 122.75 3.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 73.310000000000002 110.831 -179.875 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.76 81.58 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.713 -0.756 . . . . 74.040000000000006 112.509 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.418 HD12 ' N ' ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.89 148.38 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.862 0.363 . . . . 74.439999999999998 111.153 -179.98 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.42 -165.95 1.8 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 73.340000000000003 110.939 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.688 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -96.81 116.98 30.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 75.120000000000005 110.859 179.833 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.725 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.9 mm -107.74 91.78 7.91 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.548 0.689 . . . . 71.030000000000001 111.096 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.455 ' HA ' HG22 ' A' ' 28' ' ' VAL . 54.0 Cg_endo -69.77 96.29 0.59 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.658 2.239 . . . . 61.100000000000001 112.359 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.441 ' HB3' HG23 ' A' ' 27' ' ' THR . 16.5 t80 -63.32 -37.6 87.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 63.409999999999997 110.956 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.504 HG21 ' HG2' ' A' ' 25' ' ' ARG . 16.4 m -128.78 147.22 50.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.111 -0.495 . . . . 61.119999999999997 111.204 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -144.19 37.22 1.25 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 73.400000000000006 110.867 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.455 ' HD3' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -128.01 -39.74 1.73 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.193 -0.458 . . . . 71.450000000000003 110.897 -179.892 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -156.76 -58.82 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.67 -0.776 . . . . 64.209999999999994 112.441 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.504 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -90.92 46.77 1.35 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.869 0.366 . . . . 74.319999999999993 110.888 -179.836 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.417 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 10.8 tttm -53.74 116.31 2.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 73.319999999999993 110.923 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.441 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -131.58 92.2 3.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.305 -0.407 . . . . 73.420000000000002 111.186 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.688 HG11 ' HB2' ' A' ' 17' ' ' ASP . 42.8 t -76.61 127.55 37.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 73.310000000000002 111.127 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.74 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.79 51.51 2.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 62.310000000000002 110.893 179.934 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 20.2 mttp -38.99 107.33 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.215 -0.448 . . . . 71.219999999999999 110.888 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.67 44.91 0.4 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.75 -0.738 . . . . 72.209999999999994 112.496 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.587 HG22 ' OH ' ' A' ' 36' ' ' TYR . 14.3 mm -105.58 90.09 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.885 0.374 . . . . 61.5 111.17 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.77 156.62 37.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 61.350000000000001 110.857 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.34 -106.65 0.27 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.784 -0.722 . . . . 52.539999999999999 112.507 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.762 HD12 ' HB ' ' A' ' 44' ' ' ILE . 65.2 mt -155.61 83.95 1.04 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.781 0.324 . . . . 71.400000000000006 110.899 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.587 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -169.99 149.66 3.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.257 -0.429 . . . . 74.140000000000001 110.972 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.2 t -167.47 25.74 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.109 -0.496 . . . . 73.400000000000006 110.859 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.636 HG13 ' HA3' ' A' ' 9' ' ' GLY . 1.9 p 179.29 -34.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 53.439999999999998 111.138 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -113.79 176.2 5.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.195 -0.457 . . . . 71.530000000000001 110.795 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.58 24.57 1.38 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.485 . . . . 74.129999999999995 110.877 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -100.82 -77.42 0.54 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 54.200000000000003 110.895 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -78.28 60.75 2.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.475 . . . . 65.019999999999996 110.892 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.0 p -87.9 162.77 16.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 74.120000000000005 110.892 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.762 ' HB ' HD12 ' A' ' 35' ' ' LEU . 21.1 mm -146.99 139.3 19.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 74.120000000000005 111.044 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.2 mtt -142.67 146.02 34.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 73.230000000000004 110.869 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.5 m-20 -95.56 -169.09 1.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.158 -0.473 . . . . 64.129999999999995 110.88 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -55.12 -60.53 3.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 53.329999999999998 110.886 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -52.67 -57.95 8.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.436 . . . . 74.319999999999993 110.877 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.53 -59.35 4.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 70.329999999999998 110.834 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.6 t -52.82 -42.39 65.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.187 -0.46 . . . . 71.310000000000002 110.815 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.25 -44.34 83.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.129 -0.487 . . . . 72.140000000000001 110.899 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.89 -61.76 1.97 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 63.450000000000003 111.157 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.437 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.8 t80 -52.44 -46.87 66.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.25 -0.432 . . . . 75.510000000000005 110.855 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.449 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.34 -49.57 73.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 72.25 110.889 179.935 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.49 -42.12 61.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 62.539999999999999 111.035 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.74 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -70.32 -66.9 0.54 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.272 -0.422 . . . . 50.130000000000003 110.961 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.449 HG22 ' HA ' ' A' ' 54' ' ' MET . 16.6 m -46.95 -35.64 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.449 . . . . 74.129999999999995 111.109 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.8 mmmm -70.42 -51.95 25.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 73.219999999999999 110.912 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.26 -51.49 53.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.277 -0.42 . . . . 72.219999999999999 111.143 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.613 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -66.41 -45.81 78.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 72.140000000000001 110.935 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.35 -46.86 56.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 72.019999999999996 110.863 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.21 -57.52 5.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 75.129999999999995 111.078 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.26 -39.2 13.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 54.299999999999997 110.85 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 60' ' ' PHE . 46.0 t -80.59 -31.28 12.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 72.400000000000006 111.126 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -48.46 -32.45 7.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 74.219999999999999 110.928 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.11 -45.92 89.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.158 -0.474 . . . . 75.049999999999997 111.16 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 47.01 -164.79 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 75.409999999999997 110.815 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.965 HG22 HG13 ' A' ' 69' ' ' VAL . 98.2 m -97.44 -75.85 0.53 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.07 -0.514 . . . . 74.540000000000006 111.133 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.965 HG13 HG22 ' A' ' 68' ' ' THR . 4.7 m -128.35 -168.16 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 73.319999999999993 111.095 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.469 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -92.83 157.49 39.42 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.509 0.671 . . . . 43.119999999999997 111.077 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.712 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.6 Cg_endo -69.76 -6.33 18.35 Favored 'Trans proline' 0 C--N 1.34 0.121 0 C-N-CA 122.669 2.246 . . . . 72.519999999999996 112.35 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -92.45 -44.6 8.58 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.23 -0.441 . . . . 71.530000000000001 110.834 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -52.9 -62.22 1.79 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 71.329999999999998 110.904 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.712 HD11 ' HA ' ' A' ' 71' ' ' PRO . 0.3 OUTLIER -44.63 -69.97 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.142 -0.481 . . . . 74.209999999999994 111.095 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 26.7 m -48.28 -39.17 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.175 -0.466 . . . . 71.120000000000005 111.12 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -59.68 -47.21 86.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 74.409999999999997 110.898 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.413 HG22 ' HB2' ' A' ' 121' ' ' ASP . 98.7 t -60.29 -39.4 80.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 74.5 111.146 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.577 HH22 HG21 ' A' ' 113' ' ' THR . 0.7 OUTLIER -64.06 -60.39 3.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 54.240000000000002 110.793 -179.875 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -63.89 -22.72 67.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.257 -0.429 . . . . 74.109999999999999 110.864 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 14.2 ttmm -68.18 -54.71 15.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.462 . . . . 71.230000000000004 110.904 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.847 ' HB2' HD23 ' A' ' 83' ' ' LEU . 9.2 mt -91.6 15.91 11.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.241 -0.436 . . . . 64.349999999999994 110.902 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.88 39.53 26.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 54.039999999999999 110.811 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.847 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.5 mm? -79.34 86.15 5.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.144 -0.48 . . . . 70.209999999999994 110.937 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.645 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -44.95 156.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.247 -0.433 . . . . 63.520000000000003 111.109 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -59.04 -20.6 54.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 75.239999999999995 110.951 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -81.35 -53.69 6.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 73.010000000000005 110.909 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.645 ' H ' HG23 ' A' ' 84' ' ' THR . 4.0 tt0 -59.57 -48.66 80.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.47 . . . . 64.099999999999994 110.81 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.45 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -56.12 -32.87 64.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.178 -0.465 . . . . 73.150000000000006 111.11 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 28.6 t -79.42 -31.63 42.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 62.399999999999999 110.828 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -79.47 -24.24 42.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 63.229999999999997 110.894 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.727 ' CD1' HD12 ' A' ' 127' ' ' LEU . 50.7 mt -103.61 -62.07 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.481 . . . . 61.130000000000003 111.158 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.541 ' HB3' HG23 ' A' ' 113' ' ' THR . 5.7 m-85 -75.31 -64.16 1.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.173 -0.467 . . . . 75.430000000000007 110.85 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 116.73 49.33 0.43 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.718 -0.753 . . . . 44.310000000000002 112.519 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -82.95 -45.39 6.7 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.701 -0.761 . . . . 41.520000000000003 112.434 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.403 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 109.66 166.89 20.05 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.762 -0.733 . . . . 71.530000000000001 112.489 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.5 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.7 p -50.91 -51.69 19.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.827 0.346 . . . . 62.219999999999999 111.096 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.5 ' N ' HG13 ' A' ' 96' ' ' VAL . 28.2 m-20 -87.23 40.21 0.91 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 71.140000000000001 110.886 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.404 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -63.86 -78.22 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.226 -0.443 . . . . 55.140000000000001 111.073 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.404 ' C ' ' O ' ' A' ' 98' ' ' ALA . 40.6 m-85 -38.2 -42.55 0.69 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.165 -0.471 . . . . 75.239999999999995 110.932 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.0 t -60.02 -74.81 0.07 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.181 -0.463 . . . . 74.310000000000002 110.851 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.518 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 34.6 mtt85 -49.64 -46.8 49.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.164 -0.471 . . . . 64.230000000000004 110.931 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -56.63 -35.47 68.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.149 -0.478 . . . . 64.349999999999994 110.886 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -77.86 -3.77 43.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 74.530000000000001 110.894 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.2 -19.1 10.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 61.219999999999999 110.927 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.84 19.83 35.79 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.703 -0.761 . . . . 73.049999999999997 112.495 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -98.39 -29.51 13.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.764 0.316 . . . . 71.230000000000004 110.826 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.518 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -99.16 26.05 6.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 22.02 111.063 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.574 HE22 HG22 ' A' ' 69' ' ' VAL . 0.0 OUTLIER -126.37 47.51 2.44 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.606 0.717 . . . . 71.140000000000001 110.937 -179.982 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.553 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.4 Cg_endo -69.7 24.94 0.17 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.669 2.246 . . . . 64.450000000000003 112.333 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.736 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 15.2 t-160 69.98 35.15 0.1 OUTLIER Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.586 0.707 . . . . 74.340000000000003 110.857 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.736 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.2 Cg_endo -69.82 -165.31 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.711 2.274 . . . . 74.129999999999995 112.259 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.5 t -79.84 -29.86 40.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.161 -0.472 . . . . 63.140000000000001 110.882 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.577 HG21 HH22 ' A' ' 78' ' ' ARG . 39.7 m -52.41 -39.25 60.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.161 -0.472 . . . . 73.420000000000002 111.184 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.894 HG21 HG21 ' A' ' 68' ' ' THR . 33.1 mm -63.45 -44.3 98.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.456 . . . . 62.530000000000001 111.138 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.708 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -65.16 -29.16 69.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.128 -0.487 . . . . 73.219999999999999 110.858 179.871 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.708 HD12 ' HG3' ' A' ' 115' ' ' LYS . 8.1 mp -81.94 -44.93 16.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.277 -0.42 . . . . 74.040000000000006 110.916 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.503 ' CD1' HG22 ' A' ' 113' ' ' THR . 39.8 mt -59.59 -48.27 82.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.456 . . . . 65.230000000000004 110.856 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.598 ' HG3' HG13 ' A' ' 119' ' ' VAL . 14.3 ptp180 -54.11 -37.61 64.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.228 -0.442 . . . . 60.539999999999999 110.928 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.598 HG13 ' HG3' ' A' ' 118' ' ' ARG . 27.4 m -91.88 -8.6 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 73.219999999999999 111.095 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.739 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -83.24 -40.06 20.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 72.209999999999994 110.917 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.413 ' HB2' HG22 ' A' ' 77' ' ' VAL . 12.5 t0 -49.72 -31.31 11.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 72.409999999999997 110.873 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.93 -19.69 17.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 73.219999999999999 110.908 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.739 ' O ' HD13 ' A' ' 120' ' ' LEU . 34.9 m-70 -127.76 87.03 56.88 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.591 0.71 . . . . 61.530000000000001 110.875 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.707 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.9 Cg_endo -69.8 3.37 2.83 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.703 2.269 . . . . 63.340000000000003 112.35 180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -116.97 -12.7 10.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 74.540000000000006 110.92 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.663 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.1 tp -53.97 -46.68 71.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.466 . . . . 71.219999999999999 110.941 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.727 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.65 -29.43 7.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.459 . . . . 64.0 110.912 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.498 HD21 HH12 ' A' ' 131' ' ' ARG . 6.4 m120 -86.56 -27.93 23.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 73.409999999999997 110.864 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.428 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -94.15 4.96 53.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 71.439999999999998 110.955 179.941 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 126' ' ' LEU . 11.7 pt -124.24 -35.01 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 75.140000000000001 111.139 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.498 HH12 HD21 ' A' ' 128' ' ' ASN . 1.4 ptt-85 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 65.420000000000002 110.922 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.613 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.849 0.357 . . . . 71.030000000000001 110.949 . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.75 -170.39 0.48 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 75.439999999999998 110.905 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 p 178.99 56.96 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.555 0.693 . . . . 43.340000000000003 110.904 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.403 ' HA ' ' CD2' ' A' ' 7' ' ' HIS . 53.4 Cg_endo -69.73 7.28 1.02 Allowed 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.658 2.239 . . . . 71.420000000000002 112.381 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.5 m -102.27 -43.3 9.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 73.209999999999994 111.114 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.9 -31.92 4.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.192 -0.458 . . . . 61.32 110.915 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.403 ' CD2' ' HA ' ' A' ' 4' ' ' PRO . 4.0 m-70 63.5 49.06 3.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.148 -0.478 . . . . 72.329999999999998 110.859 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 72.6 mm-40 -117.13 -75.6 0.58 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 75.219999999999999 110.881 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -93.76 -117.14 2.71 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.728 -0.749 . . . . 52.109999999999999 112.561 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.613 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 8.0 pt-20 -174.08 93.27 0.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.857 0.36 . . . . 70.420000000000002 110.887 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.54 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.2 ptp -52.65 106.1 0.15 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 75.519999999999996 110.931 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.428 HG12 ' O ' ' A' ' 10' ' ' GLU . 7.5 p -147.41 127.81 5.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.238 -0.437 . . . . 64.129999999999995 111.176 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.574 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -45.38 127.45 7.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 73.310000000000002 110.864 -179.781 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.95 81.74 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.741 -0.742 . . . . 74.040000000000006 112.467 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.412 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.38 147.34 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.887 0.375 . . . . 74.439999999999998 111.12 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.32 -165.77 1.77 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 73.340000000000003 110.906 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.672 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -96.38 116.66 29.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 75.120000000000005 110.856 179.918 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.698 ' O ' HD22 ' A' ' 29' ' ' LEU . 10.0 mm -107.62 92.44 8.62 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.644 0.735 . . . . 71.030000000000001 111.138 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.434 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.9 Cg_endo -69.78 96.88 0.61 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.688 2.259 . . . . 61.100000000000001 112.345 179.888 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.505 ' HB3' HG23 ' A' ' 27' ' ' THR . 18.3 t80 -62.65 -38.45 90.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 63.409999999999997 110.93 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.521 HG21 ' HG2' ' A' ' 25' ' ' ARG . 16.8 m -129.04 145.38 51.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.071 -0.513 . . . . 61.119999999999997 111.125 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -135.48 46.51 2.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 73.400000000000006 110.886 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.423 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -131.79 -68.39 0.64 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.163 -0.471 . . . . 71.450000000000003 110.908 -179.915 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -137.21 -42.71 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.718 -0.754 . . . . 64.209999999999994 112.463 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.521 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -98.03 39.4 1.23 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.852 0.358 . . . . 74.319999999999993 110.865 -179.883 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.407 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 12.8 tttm -51.64 117.27 2.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.287 -0.415 . . . . 73.319999999999993 110.915 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.505 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -129.66 92.15 3.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.257 -0.429 . . . . 73.420000000000002 111.119 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.672 HG11 ' HB2' ' A' ' 17' ' ' ASP . 40.4 t -76.77 127.18 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 73.310000000000002 111.189 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.76 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.83 51.92 2.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.474 . . . . 62.310000000000002 110.885 -179.993 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.1 mttm -39.14 106.94 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 71.219999999999999 110.899 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.91 45.3 0.38 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.795 -0.717 . . . . 72.209999999999994 112.498 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.575 HG22 ' OH ' ' A' ' 36' ' ' TYR . 14.4 mm -105.93 91.3 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.834 0.35 . . . . 61.5 111.195 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.85 158.59 33.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.246 -0.434 . . . . 61.350000000000001 110.848 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 163.11 -105.99 0.27 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.709 -0.758 . . . . 52.539999999999999 112.45 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.742 HD12 ' HB ' ' A' ' 44' ' ' ILE . 46.9 mt -156.67 83.4 0.96 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.789 0.328 . . . . 71.400000000000006 110.952 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.575 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -168.96 169.44 9.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.204 -0.453 . . . . 74.140000000000001 110.906 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.51 -33.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.061 -0.518 . . . . 73.400000000000006 110.909 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 p -120.23 -45.76 2.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 53.439999999999998 111.098 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -99.4 178.44 4.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 71.530000000000001 110.821 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 24.1 p -148.88 29.95 0.81 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.206 -0.452 . . . . 74.129999999999995 110.887 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -104.52 -77.27 0.58 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.453 . . . . 54.200000000000003 110.865 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -77.55 59.95 2.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.504 . . . . 65.019999999999996 110.881 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.7 p -83.74 158.88 21.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 74.120000000000005 110.832 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.742 ' HB ' HD12 ' A' ' 35' ' ' LEU . 28.1 mm -144.34 140.81 24.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.1 -0.5 . . . . 74.120000000000005 111.08 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.9 mtt -144.76 142.38 29.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.136 -0.484 . . . . 73.230000000000004 110.834 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.0 m-20 -90.76 -172.96 3.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 64.129999999999995 110.894 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.52 -62.1 1.84 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.47 . . . . 53.329999999999998 110.932 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -51.05 -58.17 6.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.155 -0.475 . . . . 74.319999999999993 110.885 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -49.13 -59.12 3.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 70.329999999999998 110.861 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.9 t -53.46 -42.05 66.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 71.310000000000002 110.895 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.24 -44.1 83.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.136 -0.484 . . . . 72.140000000000001 110.867 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.33 -61.37 2.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 63.450000000000003 111.048 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.455 ' CZ ' HG11 ' A' ' 57' ' ' VAL . 19.4 t80 -52.83 -46.66 67.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 75.510000000000005 110.873 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.43 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.55 -49.61 72.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.49 . . . . 72.25 110.853 180.0 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.61 -42.77 62.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.276 -0.42 . . . . 62.539999999999999 111.033 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.76 ' HB3' HD12 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -70.04 -66.79 0.55 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 50.130000000000003 110.879 -179.89 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.455 HG11 ' CZ ' ' A' ' 53' ' ' PHE . 17.7 m -46.68 -35.63 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 74.129999999999995 111.134 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -70.56 -51.01 31.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.468 . . . . 73.219999999999999 110.857 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.74 -51.18 58.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.302 -0.408 . . . . 72.219999999999999 111.038 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.607 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -67.34 -45.09 77.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.25 -0.432 . . . . 72.140000000000001 110.894 -179.898 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 -50.63 -50.55 53.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.177 -0.465 . . . . 72.019999999999996 110.88 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.24 -56.26 12.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.452 . . . . 75.129999999999995 111.156 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -46.67 -42.99 17.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 54.299999999999997 110.892 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 60' ' ' PHE . 57.3 t -74.09 -34.33 38.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 72.400000000000006 111.146 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -48.2 -34.07 9.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.219999999999999 110.882 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -52.77 -48.13 67.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 75.049999999999997 111.098 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 40.95 -99.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.153 -0.476 . . . . 75.409999999999997 110.884 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.771 HG22 HG13 ' A' ' 69' ' ' VAL . 88.3 m -50.87 -75.7 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 74.540000000000006 111.159 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.771 HG13 HG22 ' A' ' 68' ' ' THR . 15.7 m -149.24 -175.6 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 73.319999999999993 111.145 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -102.99 154.14 37.77 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.601 0.715 . . . . 43.119999999999997 111.118 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.597 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.6 Cg_endo -69.74 -7.67 21.65 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.721 2.281 . . . . 72.519999999999996 112.31 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -95.98 -38.92 10.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 71.530000000000001 110.88 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.531 ' O ' HG23 ' A' ' 77' ' ' VAL . 12.3 t80 -56.23 -59.98 4.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.49 . . . . 71.329999999999998 110.9 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.775 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -45.22 -68.79 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.104 -0.498 . . . . 74.209999999999994 111.16 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.6 m -48.75 -39.1 10.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 71.120000000000005 111.144 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -61.04 -38.19 85.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 74.409999999999997 110.875 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 73' ' ' PHE . 55.2 t -70.88 -37.15 67.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.247 -0.433 . . . . 74.5 111.163 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.6 OUTLIER -70.81 -33.16 70.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 54.240000000000002 110.857 -179.94 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.37 -20.1 24.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.195 -0.457 . . . . 74.109999999999999 110.936 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.474 ' HG2' HD23 ' A' ' 81' ' ' LEU . 1.2 ttmm -76.19 -51.5 11.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 71.230000000000004 110.956 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.812 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.3 mt -89.89 13.56 14.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.237 -0.438 . . . . 64.349999999999994 110.914 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.24 42.16 28.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 54.039999999999999 110.953 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.812 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.4 mm? -78.73 85.03 4.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.041 -0.527 . . . . 70.209999999999994 110.904 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.632 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.22 156.66 0.15 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.124 -0.489 . . . . 63.520000000000003 111.086 179.947 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -57.64 -23.01 48.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 75.239999999999995 110.911 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.0 mttm -79.47 -53.29 7.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 73.010000000000005 110.904 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.632 ' H ' HG23 ' A' ' 84' ' ' THR . 3.0 tt0 -63.66 -53.72 47.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 64.099999999999994 110.905 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.559 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -53.65 -36.31 61.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.087 -0.506 . . . . 73.150000000000006 111.147 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.7 t -79.01 -28.81 43.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 62.399999999999999 110.824 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -78.08 -29.56 49.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.108 -0.496 . . . . 63.229999999999997 110.885 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.77 HD12 ' HB3' ' A' ' 131' ' ' ARG . 18.3 mm -98.8 -58.24 3.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.096 -0.502 . . . . 61.130000000000003 111.18 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.547 ' HB3' HG23 ' A' ' 113' ' ' THR . 5.5 m-85 -77.11 -64.36 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 75.430000000000007 110.842 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 110.54 45.37 0.91 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.786 -0.721 . . . . 44.310000000000002 112.479 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.71 -45.04 93.95 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.67 -0.776 . . . . 41.520000000000003 112.513 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.04 172.23 21.75 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.72 -0.752 . . . . 71.530000000000001 112.464 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.675 HG13 ' H ' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -50.53 -66.52 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.873 0.368 . . . . 62.219999999999999 111.161 -179.992 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.675 ' H ' HG13 ' A' ' 96' ' ' VAL . 8.4 t30 -86.21 42.4 0.99 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.471 . . . . 71.140000000000001 110.945 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.41 -76.17 0.06 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.124 -0.489 . . . . 55.140000000000001 111.084 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -39.69 -39.49 0.77 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.433 . . . . 75.239999999999995 110.866 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.9 m -61.01 -76.31 0.05 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 74.310000000000002 110.89 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.607 ' HB3' ' HB2' ' A' ' 107' ' ' ALA . 29.0 mtt85 -50.04 -45.61 52.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 64.230000000000004 110.855 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.434 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.9 m-85 -57.6 -37.22 72.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 64.349999999999994 110.941 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -62.75 -16.92 59.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 74.530000000000001 110.86 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.94 -20.54 12.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.238 -0.437 . . . . 61.219999999999999 110.926 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.8 28.75 11.65 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.724 -0.75 . . . . 73.049999999999997 112.458 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -106.71 -8.55 16.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.846 0.355 . . . . 71.230000000000004 110.905 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.607 ' HB2' ' HB3' ' A' ' 101' ' ' ARG . . . -115.06 13.65 16.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 22.02 111.088 179.888 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.467 ' HB2' HD11 ' A' ' 114' ' ' ILE . 1.9 pt20 -126.48 55.72 14.75 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.618 0.723 . . . . 71.140000000000001 110.863 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.502 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.5 Cg_endo -69.78 36.54 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.661 2.241 . . . . 64.450000000000003 112.358 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.753 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 1.0 OUTLIER 72.05 33.92 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.551 0.691 . . . . 74.340000000000003 110.828 179.917 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.753 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.2 Cg_endo -69.7 -164.14 0.12 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.722 2.281 . . . . 74.129999999999995 112.364 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.35 -32.81 32.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 63.140000000000001 110.861 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.547 HG23 ' HB3' ' A' ' 92' ' ' PHE . 22.7 m -52.7 -54.09 38.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.158 -0.474 . . . . 73.420000000000002 111.18 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.467 HD11 ' HB2' ' A' ' 108' ' ' GLN . 46.4 mm -50.95 -45.24 28.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 62.530000000000001 111.165 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.484 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -63.75 -29.51 70.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 73.219999999999999 110.89 179.867 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.484 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.3 mp -80.01 -49.86 11.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.199 -0.455 . . . . 74.040000000000006 110.917 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.775 HD13 HG22 ' A' ' 74' ' ' ILE . 20.6 mt -55.42 -47.97 75.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 65.230000000000004 110.91 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.682 ' HG3' HG13 ' A' ' 119' ' ' VAL . 17.3 ptp180 -55.18 -35.54 64.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 60.539999999999999 110.908 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.682 HG13 ' HG3' ' A' ' 118' ' ' ARG . 18.8 m -96.95 0.32 10.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 73.219999999999999 111.132 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.736 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.7 OUTLIER -93.1 -36.52 12.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 72.209999999999994 110.878 179.95 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -53.03 -24.37 9.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.12 -0.491 . . . . 72.409999999999997 110.882 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.481 ' HD3' ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -99.7 -20.2 16.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 73.219999999999999 110.935 179.982 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.736 ' O ' HD13 ' A' ' 120' ' ' LEU . 52.3 m80 -132.52 93.4 25.02 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.604 0.716 . . . . 61.530000000000001 110.934 179.815 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.605 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.7 Cg_endo -69.77 -0.02 6.32 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.7 2.267 . . . . 63.340000000000003 112.333 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -114.31 -11.34 12.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.259 -0.428 . . . . 74.540000000000006 110.902 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.682 ' O ' HG23 ' A' ' 130' ' ' ILE . 7.8 tp -53.27 -49.15 67.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.122 -0.49 . . . . 71.219999999999999 110.861 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.743 HD13 HD11 ' A' ' 83' ' ' LEU . 2.0 pt? -51.28 -28.86 13.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.276 -0.42 . . . . 64.0 110.863 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.487 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.36 -27.11 24.46 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.216 -0.447 . . . . 73.409999999999997 110.844 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.402 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.1 pp20? -94.12 2.46 55.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.269 -0.423 . . . . 71.439999999999998 110.899 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.682 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.3 pt -121.47 -34.26 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 75.140000000000001 111.176 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.77 ' HB3' HD12 ' A' ' 91' ' ' ILE . 2.5 ptt-85 . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.104 -0.498 . . . . 65.420000000000002 110.826 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mtt . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.867 0.365 . . . . 71.03 110.88 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.34 -170.58 0.53 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 75.44 110.846 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.435 ' O ' ' N ' ' A' ' 7' ' ' HIS . 0.1 OUTLIER 174.27 59.1 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.596 0.713 . . . . 43.34 110.847 179.922 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -2.64 10.54 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.689 2.259 . . . . 71.42 112.328 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.466 HG23 ' N ' ' A' ' 6' ' ' CYS . 30.5 m -84.08 -43.14 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.255 -0.429 . . . . 73.21 111.106 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.466 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.8 OUTLIER -125.77 -28.62 3.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 61.32 110.888 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.435 ' N ' ' O ' ' A' ' 3' ' ' CYS . 21.3 m-70 67.66 46.31 1.35 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 72.33 110.878 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -107.6 -74.05 0.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.434 . . . . 75.22 110.872 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.81 -134.72 8.55 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.719 -0.753 . . . . 52.11 112.483 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.477 ' O ' HG12 ' A' ' 12' ' ' VAL . 5.9 pt-20 -155.19 88.26 1.16 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 70.42 110.863 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.551 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -48.97 105.5 0.08 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 75.52 110.895 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.477 HG12 ' O ' ' A' ' 10' ' ' GLU . 3.9 p -142.01 126.65 16.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 64.13 111.145 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.586 ' N ' HD23 ' A' ' 35' ' ' LEU . 2.4 p -49.09 130.98 19.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 73.31 110.865 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.411 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 178.94 80.76 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.748 -0.739 . . . . 74.04 112.464 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.415 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.12 146.83 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.93 0.395 . . . . 74.44 111.108 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.8 -165.51 1.66 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.124 -0.489 . . . . 73.34 110.893 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.679 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -95.59 116.97 29.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.235 -0.439 . . . . 75.12 110.907 179.861 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.713 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.2 mm -107.59 91.96 7.93 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.652 0.739 . . . . 71.03 111.142 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.431 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.9 Cg_endo -69.76 96.89 0.61 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.654 2.236 . . . . 61.1 112.344 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.425 ' HB3' HG23 ' A' ' 27' ' ' THR . 15.0 t80 -64.5 -36.92 85.74 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 63.41 110.919 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.491 HG21 ' HG2' ' A' ' 25' ' ' ARG . 16.7 m -128.87 146.79 50.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 61.12 111.139 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.8 p90 -143.87 36.18 1.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 73.4 110.882 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.55 -40.23 2.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 71.45 110.854 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -157.42 -57.92 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.713 -0.756 . . . . 64.21 112.478 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.491 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -91.18 46.31 1.3 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.876 0.37 . . . . 74.32 110.882 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.414 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 14.4 tttm -53.09 116.48 2.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 73.32 110.887 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.425 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -130.74 92.55 3.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 73.42 111.123 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.679 HG11 ' HB2' ' A' ' 17' ' ' ASP . 44.5 t -77.07 127.55 38.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 73.31 111.073 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.742 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -85.05 51.43 2.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 62.31 110.893 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 29' ' ' LEU . 19.0 mttm -38.08 107.69 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 71.22 110.933 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 119.45 46.58 0.4 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.764 -0.732 . . . . 72.21 112.534 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.576 HD11 ' HB3' ' A' ' 29' ' ' LEU . 15.1 mm -107.73 91.69 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.884 0.373 . . . . 61.5 111.117 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.27 154.61 38.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 61.35 110.883 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 168.32 -109.33 0.33 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.761 -0.733 . . . . 52.54 112.502 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.74 HD12 ' HB ' ' A' ' 44' ' ' ILE . 53.8 mt -156.98 87.0 0.98 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.856 0.36 . . . . 71.4 110.897 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -159.73 160.18 33.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 74.14 110.921 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.7 t -171.82 -40.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.137 -0.483 . . . . 73.4 110.905 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 39' ' ' HIS . 2.6 p -120.9 -46.54 2.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 53.44 111.139 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.407 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -92.1 170.65 9.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.494 . . . . 71.53 110.807 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.47 21.12 2.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.196 -0.456 . . . . 74.13 110.877 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -112.0 -61.79 1.66 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 54.2 110.863 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.526 ' HG3' ' HE3' ' A' ' 11' ' ' MET . 11.5 tp10 -77.34 61.67 2.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 65.02 110.874 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.0 p -95.24 154.28 17.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 74.12 110.859 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.74 ' HB ' HD12 ' A' ' 35' ' ' LEU . 19.0 mm -140.89 139.84 33.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 74.12 111.136 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.6 mtt -142.15 143.84 33.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 73.23 110.909 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.1 m-20 -92.51 -169.67 2.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.236 -0.438 . . . . 64.13 110.893 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -60.92 2.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 53.33 110.902 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.91 -57.58 8.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.262 -0.427 . . . . 74.32 110.857 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.72 -58.01 6.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 70.33 110.865 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.8 t -53.65 -42.64 68.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 71.31 110.809 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.2 -44.14 83.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.164 -0.471 . . . . 72.14 110.856 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.14 -62.08 1.75 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 63.45 111.093 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.463 ' O ' HG13 ' A' ' 57' ' ' VAL . 20.8 t80 -52.05 -46.21 65.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 75.51 110.834 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.42 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.94 -51.33 64.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 72.25 110.905 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -50.51 -40.24 50.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.444 . . . . 62.54 111.099 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.742 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.5 mt-30 -72.07 -67.85 0.51 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 50.13 110.902 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.463 HG13 ' O ' ' A' ' 53' ' ' PHE . 15.2 m -46.47 -36.87 3.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.448 . . . . 74.13 111.135 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.62 -50.73 33.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 73.22 110.908 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.11 -50.99 60.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 72.22 111.066 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.637 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -66.53 -46.16 77.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 72.14 110.874 -179.888 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.48 -51.51 35.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.133 -0.485 . . . . 72.02 110.872 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.37 -54.68 25.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 75.13 111.095 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.08 -40.53 32.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.243 -0.435 . . . . 54.3 110.86 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.637 HG23 ' O ' ' A' ' 60' ' ' PHE . 42.4 t -79.68 -27.4 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.132 -0.485 . . . . 72.4 111.15 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 74.22 110.905 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 4.6 m . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.847 0.356 . . . . 73.32 111.1 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.535 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.02 159.41 29.74 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.587 0.708 . . . . 43.12 111.079 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.683 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.3 Cg_endo -69.8 -7.54 21.34 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.682 2.255 . . . . 72.52 112.292 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -92.19 -39.5 11.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 71.53 110.876 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -57.34 -61.17 2.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 71.33 110.88 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.683 HD11 ' HA ' ' A' ' 71' ' ' PRO . 0.3 OUTLIER -44.74 -68.11 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 74.21 111.136 179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.1 m -48.85 -39.09 11.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 71.12 111.144 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.6 mtmt -60.4 -39.41 87.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 74.41 110.9 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.458 ' HB ' HD22 ' A' ' 117' ' ' LEU . 99.6 t -70.35 -37.97 72.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 74.5 111.167 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.66 -33.33 72.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 54.24 110.859 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.1 pttt -89.53 -19.25 25.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 74.11 110.886 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 21.8 ttmt -75.97 -51.19 12.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 71.23 110.87 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.851 HD13 HD12 ' A' ' 120' ' ' LEU . 8.3 mt -92.09 14.66 15.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.205 -0.452 . . . . 64.35 110.915 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.32 41.13 27.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 54.04 110.881 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.842 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.5 mm? -79.04 86.46 4.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.138 -0.483 . . . . 70.21 110.872 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.668 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -45.83 156.05 0.15 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 63.52 111.157 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.23 -19.41 54.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 75.24 110.883 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -53.21 6.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 73.01 110.917 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.668 ' H ' HG23 ' A' ' 84' ' ' THR . 1.2 tt0 -62.63 -49.34 75.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.234 -0.439 . . . . 64.1 110.946 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.443 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -55.57 -31.64 62.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 73.15 111.153 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 24.5 p -80.02 -35.79 36.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 62.4 110.885 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -74.81 -22.82 58.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.09 -0.504 . . . . 63.23 110.904 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.704 ' CD1' HD12 ' A' ' 127' ' ' LEU . 52.8 mt -103.71 -62.87 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 61.13 111.142 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.552 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.8 m-85 -75.64 -63.95 1.18 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 75.43 110.902 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 124.69 34.36 0.7 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.731 -0.747 . . . . 44.31 112.475 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -52.01 -50.14 46.2 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.743 -0.741 . . . . 41.52 112.51 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.95 -137.11 13.88 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.739 -0.743 . . . . 71.53 112.526 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.14 -73.36 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.781 0.324 . . . . 62.22 111.147 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -85.25 40.94 0.85 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 71.14 110.89 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -60.35 -75.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 55.14 111.053 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.417 ' C ' ' O ' ' A' ' 98' ' ' ALA . 25.4 m-85 -36.38 -47.03 0.58 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 75.24 110.849 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.1 m -57.38 -76.08 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.481 . . . . 74.31 110.899 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.531 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 8.0 mtt180 -47.39 -52.8 15.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.08 -0.509 . . . . 64.23 110.859 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.568 ' HB3' HD12 ' A' ' 74' ' ' ILE . 10.6 m-85 -49.67 -38.26 31.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 64.35 110.923 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -54.33 -38.85 66.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.13 -0.486 . . . . 74.53 110.894 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.22 -17.32 22.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.139 -0.482 . . . . 61.22 110.916 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.28 26.19 16.7 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.751 -0.738 . . . . 73.05 112.47 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 74.7 m-80 -94.3 -24.65 17.34 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.863 0.363 . . . . 71.23 110.925 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.531 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -105.05 18.7 21.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 22.02 111.085 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.495 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.6 tm0? -120.39 55.98 4.39 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.637 0.732 . . . . 71.14 110.941 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.4 Cg_endo -69.77 28.67 0.18 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.664 2.243 . . . . 64.45 112.334 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.694 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.9 OUTLIER 69.42 38.37 0.17 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.547 0.689 . . . . 74.34 110.842 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.694 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.5 Cg_endo -69.7 -165.49 0.15 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.689 2.259 . . . . 74.13 112.369 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 14.1 m -81.46 -34.41 31.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 63.14 110.845 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.552 HG23 ' HB3' ' A' ' 92' ' ' PHE . 14.8 m -48.78 -42.34 35.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 73.42 111.192 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.421 HD11 ' HG2' ' A' ' 108' ' ' GLN . 27.7 mm -60.26 -44.0 94.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 62.53 111.133 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.658 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -64.18 -29.34 70.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.169 -0.469 . . . . 73.22 110.864 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.658 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.6 mp -81.24 -42.83 20.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.244 -0.435 . . . . 74.04 110.881 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.638 HD13 HG22 ' A' ' 74' ' ' ILE . 36.1 mt -61.09 -49.45 77.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 65.23 110.925 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.561 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.7 ptp180 -51.92 -39.76 59.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 60.54 110.914 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.561 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.8 m -88.13 -13.01 10.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 73.22 111.092 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.851 HD12 HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -79.06 -41.35 29.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 72.21 110.874 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -48.79 -32.82 9.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 72.41 110.876 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.2 -21.39 17.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 73.22 110.941 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.74 ' O ' HD13 ' A' ' 120' ' ' LEU . 42.1 m-70 -126.52 87.66 55.94 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.552 0.691 . . . . 61.53 110.863 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.658 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.5 Cg_endo -69.71 3.37 2.78 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.692 2.261 . . . . 63.34 112.392 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -117.22 -12.45 10.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.177 -0.465 . . . . 74.54 110.898 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.663 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.2 tp -54.06 -46.57 72.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.168 -0.469 . . . . 71.22 110.932 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.704 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.73 -29.42 7.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 64.0 110.891 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.492 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.59 -27.55 23.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 73.41 110.885 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.43 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -94.68 5.03 53.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 71.44 110.859 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 126' ' ' LEU . 11.6 pt -124.29 -35.12 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.471 . . . . 75.14 111.117 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.492 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.2 ptt-85 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.178 -0.465 . . . . 65.42 110.893 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.51 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.895 0.379 . . . . 71.03 110.917 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.83 -169.04 0.39 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 75.44 110.893 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.8 p 176.73 59.86 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.382 0 CA-C-O 121.576 0.703 . . . . 43.34 110.883 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.84 4.8 2.02 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.646 2.231 . . . . 71.42 112.297 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.2 m -104.01 -45.79 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.436 . . . . 73.21 111.141 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.4 m -107.77 -34.15 7.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 61.32 110.885 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 61.03 46.45 8.3 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.089 -0.505 . . . . 72.33 110.896 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -109.35 -74.21 0.66 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.166 -0.47 . . . . 75.22 110.943 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.541 ' HA3' HG23 ' A' ' 38' ' ' VAL . . . -107.95 -106.9 3.12 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.695 -0.764 . . . . 52.11 112.535 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.51 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 5.5 pt-20 -176.56 96.37 0.05 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.89 0.376 . . . . 70.42 110.889 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.595 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.8 ptp -52.58 104.76 0.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.168 -0.469 . . . . 75.52 110.92 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.497 HG12 ' O ' ' A' ' 10' ' ' GLU . 4.2 p -143.02 126.1 13.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.254 -0.43 . . . . 64.13 111.151 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.595 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -49.77 128.37 17.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.124 -0.489 . . . . 73.31 110.861 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.416 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.26 84.28 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.778 -0.725 . . . . 74.04 112.532 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.416 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.67 145.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.872 0.368 . . . . 74.44 111.146 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.53 -167.28 2.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 73.34 110.856 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.692 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -93.44 118.15 30.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 75.12 110.86 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.736 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.3 mm -109.28 91.17 9.28 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.667 0.746 . . . . 71.03 111.161 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.473 ' HA ' HG22 ' A' ' 28' ' ' VAL . 54.3 Cg_endo -69.67 95.81 0.56 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.745 2.297 . . . . 61.1 112.404 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -63.43 -37.27 86.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 63.41 110.901 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.485 HG21 ' HG2' ' A' ' 25' ' ' ARG . 19.2 m -131.21 149.67 52.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.091 -0.504 . . . . 61.12 111.205 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -148.51 44.22 1.02 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.27 -0.423 . . . . 73.4 110.926 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.29 -46.14 0.77 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.117 -0.492 . . . . 71.45 110.84 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -149.08 -50.46 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.67 -0.776 . . . . 64.21 112.469 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.485 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -101.7 47.1 0.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.912 0.387 . . . . 74.32 110.876 -179.827 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.428 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 14.8 tttt -55.33 121.62 9.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 73.32 110.9 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.416 ' O ' HG23 ' A' ' 27' ' ' THR . 1.8 t -138.52 93.83 2.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 73.42 111.134 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.692 HG11 ' HB2' ' A' ' 17' ' ' ASP . 44.2 t -77.55 128.14 38.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 73.31 111.104 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.745 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.2 OUTLIER -84.51 51.92 2.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 62.31 110.955 179.906 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 29' ' ' LEU . 29.0 mttp -37.4 107.7 0.07 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 71.22 110.859 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.27 50.05 0.39 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.713 -0.756 . . . . 72.21 112.478 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.6 HD11 ' HB3' ' A' ' 29' ' ' LEU . 19.0 mm -109.36 93.04 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.787 0.327 . . . . 61.5 111.166 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.27 150.7 38.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 61.35 110.822 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.9 -106.12 0.25 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.805 -0.712 . . . . 52.54 112.501 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.774 HD12 ' HB ' ' A' ' 44' ' ' ILE . 43.5 mt -156.65 84.82 0.97 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.875 0.369 . . . . 71.4 110.873 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.497 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -158.74 162.51 37.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 74.14 110.916 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.2 t -171.28 -37.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.094 -0.503 . . . . 73.4 110.904 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.541 HG23 ' HA3' ' A' ' 9' ' ' GLY . 0.3 OUTLIER -128.13 -40.56 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 53.44 111.141 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -97.05 170.89 8.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.129 -0.487 . . . . 71.53 110.835 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.25 12.96 2.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.216 -0.447 . . . . 74.13 110.866 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -103.07 -65.2 1.01 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 54.2 110.872 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -76.98 61.46 1.97 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.193 -0.458 . . . . 65.02 110.886 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.5 m -102.06 160.6 14.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 74.12 110.814 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.774 ' HB ' HD12 ' A' ' 35' ' ' LEU . 15.3 mm -141.14 140.79 31.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.118 -0.492 . . . . 74.12 111.135 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 16.2 mtm -143.8 132.45 22.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.087 -0.506 . . . . 73.23 110.889 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 35.8 m-20 -82.65 -169.72 2.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 64.13 110.871 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -61.44 2.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 53.33 110.87 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -51.63 -57.47 9.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.406 . . . . 74.32 110.872 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -50.54 -57.08 8.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 70.33 110.94 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.0 t -55.08 -40.06 69.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.495 . . . . 71.31 110.871 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.44 -45.62 88.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.129 -0.487 . . . . 72.14 110.877 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.22 -59.98 3.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 63.45 111.096 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.432 ' O ' HG13 ' A' ' 57' ' ' VAL . 14.8 t80 -53.32 -48.51 68.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.267 -0.424 . . . . 75.51 110.832 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.423 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.28 -48.48 79.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 72.25 110.886 179.956 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.2 -41.51 62.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 62.54 111.137 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.745 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.7 mt-30 -70.28 -66.67 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 50.13 110.854 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.458 HG12 HD21 ' A' ' 29' ' ' LEU . 12.0 m -47.5 -35.79 4.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.275 -0.42 . . . . 74.13 111.148 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -69.43 -54.48 14.17 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.188 -0.46 . . . . 73.22 110.858 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.16 -52.25 27.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 72.22 111.116 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.629 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -63.32 -48.61 77.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.204 -0.453 . . . . 72.14 110.88 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.8 -36.49 37.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 72.02 110.856 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.58 -53.75 9.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.462 . . . . 75.13 111.116 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.34 -25.73 64.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 54.3 110.84 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.629 HG22 ' O ' ' A' ' 60' ' ' PHE . 16.3 m -97.48 -16.24 7.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.467 . . . . 72.4 111.092 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.23 -0.441 . . . . 74.22 110.899 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 10.8 m . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.768 0.318 . . . . 73.32 111.169 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.537 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -105.24 159.44 29.4 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.559 0.695 . . . . 43.12 111.105 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.644 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.2 Cg_endo -69.79 -7.37 20.9 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.686 2.258 . . . . 72.52 112.369 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -92.26 -38.72 11.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.434 . . . . 71.53 110.832 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -57.58 -61.36 2.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 71.33 110.898 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.804 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -45.15 -67.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 74.21 111.183 179.933 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.8 m -48.88 -39.33 11.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 71.12 111.098 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 23.1 mtmt -61.14 -45.04 96.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 74.41 110.864 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.596 HG22 ' HB2' ' A' ' 121' ' ' ASP . 75.8 t -61.81 -39.05 82.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.234 -0.439 . . . . 74.5 111.118 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.451 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -64.37 -58.71 5.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 54.24 110.924 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -24.91 67.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 74.11 110.937 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 18.5 ttmt -68.23 -52.02 38.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.184 -0.462 . . . . 71.23 110.898 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.847 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.5 mt -91.82 12.53 21.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 64.35 110.898 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.1 t 53.74 37.48 26.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 54.04 110.898 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.847 HD23 ' HB2' ' A' ' 81' ' ' LEU . 2.0 mm? -79.69 87.31 5.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 70.21 110.922 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.644 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.73 156.38 0.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 63.52 111.129 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.14 -21.15 58.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 75.24 110.899 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -50.13 10.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.254 -0.43 . . . . 73.01 110.873 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.644 ' H ' HG23 ' A' ' 84' ' ' THR . 0.9 OUTLIER -64.95 -53.0 53.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 64.1 110.84 179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -52.19 -33.66 41.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.135 -0.484 . . . . 73.15 111.072 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 23.1 t -79.56 -36.61 38.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 62.4 110.837 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -72.95 -24.38 60.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.112 -0.495 . . . . 63.23 110.939 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.713 ' CD1' HD12 ' A' ' 127' ' ' LEU . 51.4 mt -101.81 -63.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 61.13 111.095 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.582 ' HB3' HG23 ' A' ' 113' ' ' THR . 8.3 m-85 -74.34 -60.68 2.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 75.43 110.826 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 110.26 49.37 0.72 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.701 -0.762 . . . . 44.31 112.438 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.88 -36.91 31.03 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.764 -0.731 . . . . 41.52 112.501 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . 0.412 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 102.82 165.08 26.03 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.771 -0.728 . . . . 71.53 112.522 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.49 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.8 p -50.93 -50.89 22.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.89 0.376 . . . . 62.22 111.12 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.49 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.7 OUTLIER -86.87 38.46 0.8 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.487 . . . . 71.14 110.89 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.412 ' HB2' ' O ' ' A' ' 95' ' ' GLY . . . -63.85 -76.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 55.14 111.097 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -43.02 -40.37 3.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 75.24 110.877 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.1 m -59.98 -75.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.145 -0.479 . . . . 74.31 110.857 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.63 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 32.5 mtt180 -50.03 -45.72 52.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.094 -0.503 . . . . 64.23 110.873 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.72 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.0 m-85 -55.41 -37.31 67.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.24 -0.436 . . . . 64.35 110.852 -179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -51.3 -30.11 17.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 74.53 110.928 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -106.96 -22.11 12.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.478 . . . . 61.22 110.889 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.69 26.75 9.57 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.784 -0.722 . . . . 73.05 112.539 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -98.06 -4.7 35.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.822 0.344 . . . . 71.23 110.83 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.63 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -112.11 8.7 20.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 22.02 111.041 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.558 ' HB2' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -124.73 57.44 15.09 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.563 0.697 . . . . 71.14 110.855 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.53 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.9 Cg_endo -69.78 36.32 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.646 2.231 . . . . 64.45 112.342 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.772 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.5 t-160 73.93 32.28 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.522 0.677 . . . . 74.34 110.846 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.772 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 52.8 Cg_endo -69.86 -163.84 0.12 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.638 2.225 . . . . 74.13 112.316 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.44 -30.26 23.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.251 -0.432 . . . . 63.14 110.845 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.582 HG23 ' HB3' ' A' ' 92' ' ' PHE . 21.1 m -53.34 -50.57 64.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.138 -0.483 . . . . 73.42 111.141 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.558 HD11 ' HB2' ' A' ' 108' ' ' GLN . 41.0 mm -51.31 -42.36 26.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 62.53 111.136 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.555 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -68.17 -29.63 68.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.166 -0.47 . . . . 73.22 110.914 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.555 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.7 mp -79.25 -42.1 26.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 74.04 110.941 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.804 HD13 HG22 ' A' ' 74' ' ' ILE . 17.0 mt -63.93 -48.93 74.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 65.23 110.909 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.597 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.9 ptp180 -52.2 -34.81 47.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 60.54 110.882 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.597 HG13 ' HG3' ' A' ' 118' ' ' ARG . 30.9 m -93.88 -13.91 8.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.475 . . . . 73.22 111.144 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.82 HD12 HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -77.14 -40.29 46.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 72.21 110.9 179.954 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . 0.596 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.5 OUTLIER -50.0 -31.23 12.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.187 -0.461 . . . . 72.41 110.822 179.88 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.35 -20.86 18.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 73.22 110.868 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.741 ' O ' HD13 ' A' ' 120' ' ' LEU . 53.7 m-70 -128.55 88.59 51.87 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.565 0.698 . . . . 61.53 110.835 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.704 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.9 Cg_endo -69.71 3.4 2.76 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.646 2.231 . . . . 63.34 112.367 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -117.83 -11.98 10.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.43 . . . . 74.54 110.912 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.527 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.5 tp -53.54 -47.99 69.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.199 -0.455 . . . . 71.22 110.976 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.713 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.9 pt? -46.32 -32.77 3.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.467 . . . . 64.0 110.871 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -81.87 -38.1 25.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.17 -0.468 . . . . 73.41 110.907 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.578 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -78.74 -6.18 55.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.458 . . . . 71.44 110.89 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.578 HG23 ' HG3' ' A' ' 129' ' ' GLU . 7.9 pt -119.17 -20.41 4.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 75.14 111.119 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.427 ' HG2' HG23 ' A' ' 91' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 65.42 110.892 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mtt . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.885 0.374 . . . . 71.03 110.88 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.02 -169.43 0.4 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 75.44 110.947 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.7 t -178.91 60.12 0.12 Allowed Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.588 0.709 . . . . 43.34 110.876 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -0.1 6.46 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 122.715 2.277 . . . . 71.42 112.324 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.628 HG21 ' OE1' ' A' ' 42' ' ' GLU . 27.8 m -87.52 -43.96 15.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.268 -0.424 . . . . 73.21 111.153 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.457 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -127.17 -30.8 2.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.474 . . . . 61.32 110.913 179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 22.1 m-70 69.79 68.91 0.23 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 72.33 110.897 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -132.52 -71.72 0.53 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 75.22 110.994 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.34 -129.99 6.84 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.71 -0.757 . . . . 52.11 112.482 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.459 ' O ' HG12 ' A' ' 12' ' ' VAL . 9.6 pt-20 -161.2 87.89 0.73 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.799 0.333 . . . . 70.42 110.88 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.561 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -50.64 105.04 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.146 -0.479 . . . . 75.52 110.874 179.951 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 10' ' ' GLU . 5.0 p -142.58 126.93 15.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 64.13 111.132 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.589 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.4 OUTLIER -49.51 129.28 18.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 73.31 110.791 -179.815 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.406 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 179.98 81.46 0.06 OUTLIER Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.72 -0.753 . . . . 74.04 112.46 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.414 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.02 146.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.912 0.386 . . . . 74.44 111.088 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.91 -165.4 1.62 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.12 -0.491 . . . . 73.34 110.854 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.654 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.6 OUTLIER -95.48 117.15 29.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 75.12 110.792 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.734 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.0 mm -107.88 91.53 7.77 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.623 0.725 . . . . 71.03 111.203 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.408 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.7 Cg_endo -69.72 96.48 0.59 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.678 2.252 . . . . 61.1 112.343 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.514 ' HB3' HG23 ' A' ' 27' ' ' THR . 16.6 t80 -61.15 -40.04 92.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 63.41 110.944 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.479 HG21 ' HG2' ' A' ' 25' ' ' ARG . 15.7 m -126.72 145.18 50.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.126 -0.488 . . . . 61.12 111.17 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -134.02 45.54 2.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 73.4 110.857 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.45 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -132.09 -68.4 0.63 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 71.45 110.911 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -136.08 -46.35 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.704 -0.76 . . . . 64.21 112.475 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.479 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.38 39.84 1.09 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.912 0.387 . . . . 74.32 110.918 -179.853 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -52.67 115.23 1.7 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.079 -0.51 . . . . 73.32 110.907 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.514 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -127.76 93.81 3.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 73.42 111.118 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.654 HG11 ' HB2' ' A' ' 17' ' ' ASP . 43.7 t -77.69 126.42 38.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 73.31 111.133 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.74 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.61 51.42 2.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 62.31 110.923 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.402 ' C ' ' O ' ' A' ' 29' ' ' LEU . 23.1 mttp -38.06 108.03 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 71.22 110.866 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.86 46.66 0.42 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.681 -0.771 . . . . 72.21 112.46 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.576 HD11 ' HB3' ' A' ' 29' ' ' LEU . 14.9 mm -107.61 91.22 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.838 0.352 . . . . 61.5 111.104 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.01 154.29 39.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.209 -0.451 . . . . 61.35 110.827 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.99 -108.57 0.31 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.709 -0.757 . . . . 52.54 112.491 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.757 HD12 ' HB ' ' A' ' 44' ' ' ILE . 49.9 mt -157.11 86.12 0.96 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.847 0.356 . . . . 71.4 110.874 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.402 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.02 161.08 33.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.151 -0.477 . . . . 74.14 110.905 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.6 t -169.58 -38.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.109 -0.496 . . . . 73.4 110.853 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.6 m -125.79 -47.18 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 53.44 111.153 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.88 170.43 10.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 71.53 110.892 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.9 t -137.4 15.91 2.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 74.13 110.863 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -104.82 -62.99 1.26 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 54.2 110.876 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.628 ' OE1' HG21 ' A' ' 5' ' ' VAL . 7.8 tp10 -77.15 61.93 2.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 65.02 110.897 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.6 p -97.09 154.21 17.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.088 -0.505 . . . . 74.12 110.891 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.757 ' HB ' HD12 ' A' ' 35' ' ' LEU . 20.1 mm -141.25 139.77 32.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 74.12 111.158 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.8 mtt -142.88 139.68 30.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.425 . . . . 73.23 110.852 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 41.1 m-20 -87.59 -169.94 2.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 64.13 110.885 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -61.03 2.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.191 -0.459 . . . . 53.33 110.843 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.48 -57.44 9.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 74.32 110.979 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.02 -58.15 6.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.031 -0.531 . . . . 70.33 110.84 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.5 t -53.49 -42.38 67.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 71.31 110.926 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.59 -44.0 85.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.093 -0.503 . . . . 72.14 110.936 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.77 -61.82 1.95 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 63.45 111.106 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.501 ' O ' HG13 ' A' ' 57' ' ' VAL . 18.1 t80 -52.6 -46.7 67.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.455 . . . . 75.51 110.859 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.44 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.41 -49.03 75.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.499 . . . . 72.25 110.91 179.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.94 -42.66 63.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.474 . . . . 62.54 111.135 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.74 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.6 mt-30 -69.65 -66.54 0.57 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 50.13 110.884 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.501 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.3 m -47.24 -35.72 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 74.13 111.143 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.7 mmmt -69.07 -54.89 12.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 73.22 110.883 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.07 -53.58 19.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.246 -0.434 . . . . 72.22 111.063 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.701 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -62.88 -49.27 75.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.45 . . . . 72.14 110.868 -179.889 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.74 -36.31 25.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 72.02 110.823 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.65 -54.04 9.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.265 -0.425 . . . . 75.13 111.158 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.21 -28.27 64.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 54.3 110.884 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.701 HG22 ' O ' ' A' ' 60' ' ' PHE . 23.2 m -94.9 -17.29 7.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.095 -0.502 . . . . 72.4 111.166 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 74.22 110.862 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 7.1 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.777 0.322 . . . . 73.32 111.144 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.546 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.8 159.95 28.06 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.617 0.722 . . . . 43.12 111.104 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.574 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.4 Cg_endo -69.86 -7.48 21.2 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.658 2.239 . . . . 72.52 112.312 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -93.92 -37.44 11.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 71.53 110.856 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -57.76 -61.58 2.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.188 -0.46 . . . . 71.33 110.896 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.792 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.92 -67.33 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.154 -0.476 . . . . 74.21 111.106 -179.984 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -48.88 -39.49 11.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 71.12 111.09 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 22.5 mtmt -60.6 -46.17 91.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.459 . . . . 74.41 110.873 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.611 HG22 ' HB2' ' A' ' 121' ' ' ASP . 73.4 t -60.92 -39.3 81.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 74.5 111.094 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.441 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -63.91 -60.73 2.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.181 -0.463 . . . . 54.24 110.848 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -22.91 66.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 74.11 110.832 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -68.94 -54.04 17.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 71.23 110.884 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.701 HD22 ' HB3' ' A' ' 124' ' ' PRO . 9.2 mt -91.52 14.69 14.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.24 -0.436 . . . . 64.35 110.909 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 11.0 m 53.19 39.47 29.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 54.04 110.838 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.694 HD22 ' CE2' ' A' ' 92' ' ' PHE . 0.4 OUTLIER -79.69 88.17 5.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 70.21 110.958 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.676 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -46.73 156.87 0.17 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 63.52 111.197 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -59.67 -19.79 51.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 75.24 110.916 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 33.2 mmtt -82.45 -52.45 6.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.194 -0.457 . . . . 73.01 110.873 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.676 ' H ' HG23 ' A' ' 84' ' ' THR . 2.8 tt0 -61.75 -51.78 66.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 64.1 110.844 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.44 -34.2 56.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 73.15 111.101 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.4 t -80.14 -31.1 39.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.245 -0.434 . . . . 62.4 110.906 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -77.84 -25.64 48.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.097 -0.502 . . . . 63.23 110.838 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.701 ' CD1' HD12 ' A' ' 127' ' ' LEU . 47.7 mt -101.23 -59.73 3.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 61.13 111.121 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.694 ' CE2' HD22 ' A' ' 83' ' ' LEU . 7.7 m-85 -77.3 -61.12 2.09 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 75.43 110.898 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.78 50.07 0.71 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.767 -0.73 . . . . 44.31 112.486 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -78.77 -38.62 23.25 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 41.52 112.474 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . 0.407 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 104.79 166.41 24.28 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.738 -0.744 . . . . 71.53 112.471 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.496 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.9 p -51.76 -50.66 31.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.892 0.377 . . . . 62.22 111.101 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.496 ' N ' HG13 ' A' ' 96' ' ' VAL . 81.4 m-20 -86.91 38.65 0.81 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 71.14 110.917 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 95' ' ' GLY . . . -64.19 -76.46 0.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 55.14 111.08 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -43.33 -40.45 3.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.218 -0.446 . . . . 75.24 110.891 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.8 m -60.09 -75.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 74.31 110.874 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.626 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 30.9 mtt180 -49.84 -45.82 50.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 64.23 110.918 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.724 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.3 m-85 -55.65 -37.28 68.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.197 -0.456 . . . . 64.35 110.904 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -51.83 -29.69 20.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.493 . . . . 74.53 110.856 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.8 -22.29 12.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 61.22 110.94 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.65 26.9 9.45 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.782 -0.723 . . . . 73.05 112.504 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -98.19 -5.85 32.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.857 0.361 . . . . 71.23 110.889 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.626 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -110.83 9.22 22.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.136 -0.484 . . . . 22.02 111.07 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.551 ' HB2' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -125.07 57.35 15.83 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.604 0.716 . . . . 71.14 110.835 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.532 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.0 Cg_endo -69.8 36.08 0.23 Allowed 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.656 2.238 . . . . 64.45 112.394 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.777 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 1.7 t-80 74.1 31.99 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.547 0.689 . . . . 74.34 110.849 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.777 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.6 Cg_endo -69.74 -163.83 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.71 2.273 . . . . 74.13 112.324 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 20.2 m -85.67 -29.58 23.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.445 . . . . 63.14 110.884 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.581 HG23 ' HB3' ' A' ' 92' ' ' PHE . 22.0 m -53.7 -50.84 65.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.113 -0.494 . . . . 73.42 111.14 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.551 HD11 ' HB2' ' A' ' 108' ' ' GLN . 39.3 mm -51.06 -42.61 24.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.249 -0.432 . . . . 62.53 111.094 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.534 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -68.08 -29.84 68.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 73.22 110.89 179.879 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.534 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.5 mp -78.82 -42.2 28.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.242 -0.435 . . . . 74.04 110.912 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.792 HD13 HG22 ' A' ' 74' ' ' ILE . 16.3 mt -64.06 -48.8 74.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 65.23 110.954 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.593 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.0 ptp180 -52.77 -34.63 54.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 60.54 110.918 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.593 HG13 ' HG3' ' A' ' 118' ' ' ARG . 29.3 m -93.66 -13.95 8.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 73.22 111.114 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.756 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -77.62 -40.2 42.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.111 -0.495 . . . . 72.21 110.899 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . 0.611 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.5 OUTLIER -50.03 -31.1 12.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 72.41 110.852 179.932 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.51 -20.63 18.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.134 -0.485 . . . . 73.22 110.929 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.756 ' O ' HD13 ' A' ' 120' ' ' LEU . 50.3 m-70 -129.01 89.56 48.29 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.643 0.735 . . . . 61.53 110.854 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.701 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.2 Cg_endo -69.72 1.05 4.76 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.703 2.269 . . . . 63.34 112.334 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -114.53 -12.51 12.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 74.54 110.932 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.687 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.8 tp -53.85 -47.76 70.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.082 -0.508 . . . . 71.22 110.979 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.701 HD12 ' CD1' ' A' ' 91' ' ' ILE . 2.6 pt? -50.5 -29.21 9.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 64.0 110.955 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.474 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.59 -26.68 24.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.183 -0.462 . . . . 73.41 110.873 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.419 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.9 OUTLIER -95.52 4.1 53.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.446 . . . . 71.44 110.917 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.687 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.3 pt -123.16 -34.7 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 75.14 111.121 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.474 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 2.8 ptt-85 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 65.42 110.902 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 mmt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.864 0.364 . . . . 71.03 110.85 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.67 -168.81 0.39 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.272 -0.422 . . . . 75.44 110.877 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 p -179.45 61.18 0.12 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.579 0.704 . . . . 43.34 110.847 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.73 -5.41 16.12 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.706 2.271 . . . . 71.42 112.319 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.571 HG12 ' N ' ' A' ' 6' ' ' CYS . 1.7 t -72.0 -60.52 2.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 73.21 111.132 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.571 ' N ' HG12 ' A' ' 5' ' ' VAL . 0.5 OUTLIER -124.23 -17.91 6.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 61.32 110.906 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 63.85 72.57 0.46 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 72.33 110.87 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -131.29 -75.55 0.52 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.146 -0.479 . . . . 75.22 110.934 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -94.3 -117.22 2.85 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.727 -0.749 . . . . 52.11 112.515 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.438 ' HG2' HG22 ' A' ' 38' ' ' VAL . 7.0 pt-20 -170.84 93.94 0.19 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.86 0.362 . . . . 70.42 110.891 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.542 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -59.23 103.06 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.466 . . . . 75.52 110.852 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.7 p -144.28 129.32 14.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.282 -0.417 . . . . 64.13 111.169 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.603 ' N ' HD23 ' A' ' 35' ' ' LEU . 9.9 p -48.31 131.8 16.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.147 -0.479 . . . . 73.31 110.813 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.42 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.98 79.72 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.748 -0.739 . . . . 74.04 112.46 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.42 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.0 144.85 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.913 0.387 . . . . 74.44 111.115 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.08 -165.61 1.76 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.475 . . . . 73.34 110.889 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.69 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -94.62 116.91 29.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 75.12 110.911 179.867 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.745 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.9 mm -108.83 90.76 7.99 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.652 0.739 . . . . 71.03 111.134 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.525 ' HA ' HG22 ' A' ' 28' ' ' VAL . 54.3 Cg_endo -69.7 96.93 0.61 Allowed 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.72 2.28 . . . . 61.1 112.332 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -64.98 -36.41 84.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.294 -0.412 . . . . 63.41 110.861 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.55 HG21 ' HG2' ' A' ' 25' ' ' ARG . 58.7 m -128.2 151.64 49.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 61.12 111.162 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -152.27 41.69 0.64 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.438 . . . . 73.4 110.908 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.56 -39.61 1.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.132 -0.485 . . . . 71.45 110.887 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -158.53 -45.14 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.76 -0.734 . . . . 64.21 112.545 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.55 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -105.71 44.8 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.892 0.377 . . . . 74.32 110.915 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.484 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 0.5 OUTLIER -51.75 118.66 3.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 73.32 110.908 179.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.416 ' O ' HG23 ' A' ' 27' ' ' THR . 1.8 t -132.91 92.36 3.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.233 -0.439 . . . . 73.42 111.12 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.69 HG11 ' HB2' ' A' ' 17' ' ' ASP . 59.1 t -76.84 128.95 37.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 73.31 111.062 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.75 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.44 52.14 2.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 62.31 110.951 179.937 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.407 ' C ' ' O ' ' A' ' 29' ' ' LEU . 32.4 mttp -36.89 107.38 0.06 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 71.22 110.908 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.05 50.15 0.4 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.715 -0.755 . . . . 72.21 112.55 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.61 HD11 ' CB ' ' A' ' 29' ' ' LEU . 20.3 mm -108.89 93.14 2.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.836 0.351 . . . . 61.5 111.152 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -76.24 152.92 36.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.464 . . . . 61.35 110.817 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.96 -108.47 0.31 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.717 -0.754 . . . . 52.54 112.479 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.756 HD12 ' HB ' ' A' ' 44' ' ' ILE . 56.0 mt -156.92 85.98 0.97 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.816 0.341 . . . . 71.4 110.956 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.468 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.23 160.57 32.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 74.14 110.926 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.3 t -162.78 -41.0 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 73.4 110.885 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.438 HG22 ' HG2' ' A' ' 10' ' ' GLU . 4.3 m -127.99 -47.38 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.212 -0.449 . . . . 53.44 111.149 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.403 ' N ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -85.9 170.0 12.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.134 -0.484 . . . . 71.53 110.883 179.926 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -136.43 8.47 3.13 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.241 -0.436 . . . . 74.13 110.928 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -97.84 -63.45 1.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 54.2 110.896 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.442 ' OE1' HG11 ' A' ' 5' ' ' VAL . 6.1 tp10 -77.03 60.96 1.91 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 65.02 110.922 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.2 p -99.65 161.98 13.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 74.12 110.816 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.756 ' HB ' HD12 ' A' ' 35' ' ' LEU . 23.2 mm -144.22 140.21 24.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.091 -0.504 . . . . 74.12 111.055 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.6 mtm -144.89 129.98 18.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.138 -0.483 . . . . 73.23 110.92 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.7 m-20 -83.38 -169.79 2.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 64.13 110.877 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.62 -57.8 10.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 53.33 110.877 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -56.16 22.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.439 . . . . 74.32 110.905 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.64 -60.1 3.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.12 -0.491 . . . . 70.33 110.973 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.3 t -54.2 -39.38 66.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 71.31 110.834 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.44 -45.88 87.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.097 -0.501 . . . . 72.14 110.924 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.74 -59.29 4.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 63.45 111.1 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.438 ' O ' HG13 ' A' ' 57' ' ' VAL . 16.8 t80 -53.42 -48.37 68.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.226 -0.443 . . . . 75.51 110.861 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.432 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.93 -48.66 77.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 72.25 110.834 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.16 -41.28 62.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.288 -0.414 . . . . 62.54 111.109 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.75 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.7 mt-30 -70.6 -66.81 0.56 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.175 -0.466 . . . . 50.13 110.893 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.467 HG12 HD21 ' A' ' 29' ' ' LEU . 13.5 m -47.28 -36.38 4.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.247 -0.433 . . . . 74.13 111.078 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -69.35 -52.94 22.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 73.22 110.865 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.56 -49.84 55.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.445 . . . . 72.22 111.122 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -65.86 -49.26 68.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.285 -0.416 . . . . 72.14 110.816 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -48.98 -44.03 40.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 72.02 110.834 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.88 -56.45 7.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 75.13 111.081 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -50.43 -43.3 54.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 54.3 110.882 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.0 p -77.84 -24.48 14.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.113 -0.494 . . . . 72.4 111.143 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.179 -0.464 . . . . 74.22 110.893 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 4.7 m . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.793 0.33 . . . . 73.32 111.144 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.54 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -104.56 159.59 28.82 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.598 0.713 . . . . 43.12 111.143 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.733 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.1 Cg_endo -69.77 -6.86 19.61 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.671 2.248 . . . . 72.52 112.385 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.93 -40.99 10.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 71.53 110.884 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -56.71 -61.13 2.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.476 . . . . 71.33 110.885 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.734 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.28 -68.87 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 74.21 111.176 179.943 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.1 m -48.73 -38.7 10.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.456 . . . . 71.12 111.109 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.1 mtmt -60.18 -40.17 89.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 74.41 110.845 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.526 HG22 ' HB2' ' A' ' 121' ' ' ASP . 82.3 t -69.58 -38.18 76.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 74.5 111.174 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -68.27 -35.39 77.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 54.24 110.882 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.0 pttt -88.06 -19.33 27.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.485 . . . . 74.11 110.923 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.431 ' HG2' HD23 ' A' ' 81' ' ' LEU . 0.7 OUTLIER -74.74 -51.73 13.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.446 . . . . 71.23 110.899 179.857 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.812 ' HB2' HD23 ' A' ' 83' ' ' LEU . 7.8 mt -92.21 14.58 15.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.449 . . . . 64.35 110.842 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.3 m 50.58 43.45 27.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 54.04 110.825 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.812 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.3 mm? -78.68 86.21 4.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.129 -0.487 . . . . 70.21 110.909 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.641 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.91 156.04 0.16 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.203 -0.453 . . . . 63.52 111.049 179.98 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -57.73 -22.49 46.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 75.24 110.881 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -79.85 -52.31 8.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 73.01 110.814 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.641 ' H ' HG23 ' A' ' 84' ' ' THR . 5.1 tp10 -62.67 -56.16 20.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.265 -0.425 . . . . 64.1 110.861 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.473 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -52.6 -34.32 50.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 73.15 111.127 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 91.9 p -80.95 -27.71 35.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.2 -0.454 . . . . 62.4 110.849 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -80.52 -26.66 37.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.48 . . . . 63.23 110.938 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.775 HD12 ' HB3' ' A' ' 131' ' ' ARG . 22.4 mm -101.29 -56.46 5.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.133 -0.485 . . . . 61.13 111.119 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.567 ' HB3' HG23 ' A' ' 113' ' ' THR . 4.7 m-85 -80.86 -62.93 1.52 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 75.43 110.933 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 110.95 52.38 0.57 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.692 -0.766 . . . . 44.31 112.469 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -80.71 -40.98 11.43 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.762 -0.733 . . . . 41.52 112.509 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 101.96 -179.87 27.55 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.746 -0.74 . . . . 71.53 112.513 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.528 HG13 ' N ' ' A' ' 97' ' ' ASN . 5.3 p -67.08 -50.55 62.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.822 0.344 . . . . 62.22 111.167 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.528 ' N ' HG13 ' A' ' 96' ' ' VAL . 8.9 p30 -86.24 31.9 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 71.14 110.937 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.63 -75.9 0.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 55.14 111.08 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -39.72 -47.34 2.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 75.24 110.87 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 40.2 t -56.92 -74.78 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 74.31 110.921 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.513 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 36.7 mtt180 -47.07 -54.48 10.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.124 -0.489 . . . . 64.23 110.87 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.616 ' HB3' HD12 ' A' ' 74' ' ' ILE . 13.2 m-85 -49.83 -37.68 31.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.45 . . . . 64.35 110.863 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -55.43 -40.65 71.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 74.53 110.904 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.26 -17.34 26.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 61.22 110.871 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.96 25.7 18.99 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.768 -0.729 . . . . 73.05 112.498 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -93.46 -27.66 16.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.831 0.348 . . . . 71.23 110.816 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.513 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -100.61 18.7 18.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 22.02 111.083 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.494 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.1 tm0? -121.65 53.74 4.23 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.62 0.724 . . . . 71.14 110.889 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 54.0 Cg_endo -69.81 28.51 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.668 2.245 . . . . 64.45 112.347 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.718 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.9 m170 70.2 36.87 0.12 Allowed Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.577 0.703 . . . . 74.34 110.88 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.718 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.5 Cg_endo -69.71 -165.37 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.64 2.227 . . . . 74.13 112.405 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.0 p -83.05 -32.64 26.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.267 -0.424 . . . . 63.14 110.913 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.567 HG23 ' HB3' ' A' ' 92' ' ' PHE . 18.5 m -49.17 -43.48 42.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.144 -0.48 . . . . 73.42 111.167 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.439 HD11 ' HG2' ' A' ' 108' ' ' GLN . 24.7 mm -58.96 -44.4 90.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 62.53 111.082 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.644 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -64.47 -28.85 69.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.466 . . . . 73.22 110.89 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.644 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.5 mp -81.14 -42.52 20.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.266 -0.424 . . . . 74.04 110.978 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.734 HD13 HG22 ' A' ' 74' ' ' ILE . 18.2 mt -61.54 -49.28 77.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 65.23 110.852 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.56 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.7 ptp180 -52.11 -39.41 59.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 60.54 110.864 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.56 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.8 m -88.34 -13.4 9.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.226 -0.443 . . . . 73.22 111.128 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.744 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -78.54 -39.88 36.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.162 -0.472 . . . . 72.21 110.923 179.979 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . 0.526 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.4 OUTLIER -50.16 -31.33 13.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 72.41 110.881 179.857 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.43 -19.49 18.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.151 -0.477 . . . . 73.22 110.963 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.744 ' O ' HD13 ' A' ' 120' ' ' LEU . 46.5 m-70 -130.05 88.46 48.41 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.613 0.72 . . . . 61.53 110.867 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.658 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.4 Cg_endo -69.83 2.74 3.3 Favored 'Trans proline' 0 C--N 1.342 0.231 0 C-N-CA 122.652 2.235 . . . . 63.34 112.311 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -116.83 -11.68 10.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.274 -0.421 . . . . 74.54 110.837 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.668 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.4 tp -53.85 -46.38 71.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 71.22 110.883 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.523 HD13 HD11 ' A' ' 83' ' ' LEU . 1.6 pt? -50.11 -29.24 8.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 64.0 110.869 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.52 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.8 m-80 -86.57 -27.48 23.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 73.41 110.928 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.426 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -94.54 4.58 53.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.19 -0.459 . . . . 71.44 110.919 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.668 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.0 pt -123.84 -35.1 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 75.14 111.146 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.775 ' HB3' HD12 ' A' ' 91' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 65.42 110.936 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 mmt . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.836 0.351 . . . . 71.03 110.849 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.56 -169.49 0.44 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.246 -0.434 . . . . 75.44 110.893 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 1.7 p 178.7 55.67 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.385 0 CA-C-O 121.516 0.674 . . . . 43.34 110.899 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 53.4 Cg_endo -69.79 -8.67 24.2 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.709 2.272 . . . . 71.42 112.277 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.665 HG21 ' CD ' ' A' ' 42' ' ' GLU . 6.8 m -67.45 -49.56 70.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 73.21 111.132 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.463 ' N ' HG23 ' A' ' 5' ' ' VAL . 1.2 m -133.19 -20.96 2.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.171 -0.468 . . . . 61.32 110.893 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 66.65 89.01 0.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.216 -0.447 . . . . 72.33 110.909 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.639 HE21 ' N ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -132.26 -65.85 0.72 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 75.22 110.94 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.508 ' HA3' HG23 ' A' ' 38' ' ' VAL . . . -129.55 -96.0 0.78 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.745 -0.74 . . . . 52.11 112.441 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.589 ' HG2' HG22 ' A' ' 38' ' ' VAL . 8.6 pt-20 -177.0 95.28 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.87 0.367 . . . . 70.42 110.86 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.565 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -62.45 102.94 0.36 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 75.52 110.909 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.7 p -144.28 129.22 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.28 -0.418 . . . . 64.13 111.166 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.628 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -48.65 130.28 17.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.154 -0.476 . . . . 73.31 110.861 -179.793 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.421 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.66 80.71 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.752 -0.737 . . . . 74.04 112.487 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.421 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.3 146.21 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.851 0.358 . . . . 74.44 111.125 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.1 -165.49 1.73 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.123 -0.489 . . . . 73.34 110.914 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.654 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -95.62 117.76 31.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.265 -0.425 . . . . 75.12 110.846 179.912 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.73 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.4 mm -108.21 91.42 8.07 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.623 0.725 . . . . 71.03 111.13 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.438 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.7 Cg_endo -69.73 96.76 0.6 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.662 2.241 . . . . 61.1 112.322 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.483 ' HB3' HG23 ' A' ' 27' ' ' THR . 10.7 t80 -63.11 -37.69 88.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.198 -0.455 . . . . 63.41 110.882 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.478 HG23 ' HD3' ' A' ' 23' ' ' ARG . 11.0 m -127.55 146.97 50.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 61.12 111.153 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -142.86 38.5 1.47 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.46 . . . . 73.4 110.86 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.478 ' HD3' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -129.64 -40.42 1.4 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.192 -0.458 . . . . 71.45 110.854 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -156.41 -58.98 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.691 -0.766 . . . . 64.21 112.459 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.475 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -90.28 47.04 1.39 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.872 0.367 . . . . 74.32 110.926 -179.878 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.406 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 11.8 tttm -54.61 113.35 1.27 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 73.32 110.936 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.483 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.8 t -127.13 92.68 3.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.241 -0.436 . . . . 73.42 111.092 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.654 HG11 ' HB2' ' A' ' 17' ' ' ASP . 44.3 t -77.06 126.87 38.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 73.31 111.133 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.742 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.64 51.19 2.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 62.31 110.921 179.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.41 ' C ' ' O ' ' A' ' 29' ' ' LEU . 22.8 mttp -37.73 108.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.466 . . . . 71.22 110.851 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.48 47.02 0.43 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.716 -0.754 . . . . 72.21 112.473 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.566 HD11 ' HB3' ' A' ' 29' ' ' LEU . 15.5 mm -107.92 90.95 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.824 0.345 . . . . 61.5 111.168 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.54 153.97 40.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.195 -0.457 . . . . 61.35 110.865 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.46 -109.0 0.32 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.714 -0.755 . . . . 52.54 112.445 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.776 HD12 ' HB ' ' A' ' 44' ' ' ILE . 56.0 mt -156.79 86.29 0.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.857 0.36 . . . . 71.4 110.885 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.433 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.34 163.16 33.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 74.14 110.854 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.1 t -164.31 -39.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 73.4 110.967 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.589 HG22 ' HG2' ' A' ' 10' ' ' GLU . 15.7 m -131.1 -44.57 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.133 -0.485 . . . . 53.44 111.115 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.432 ' N ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -89.47 169.7 11.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 71.53 110.787 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 98.2 m -134.94 7.14 3.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.153 -0.476 . . . . 74.13 110.934 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -94.03 -65.07 1.01 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.176 -0.465 . . . . 54.2 110.895 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.665 ' CD ' HG21 ' A' ' 5' ' ' VAL . 16.0 tp10 -76.21 61.29 1.59 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.133 -0.485 . . . . 65.02 110.929 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.9 p -100.13 158.4 15.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 74.12 110.902 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.776 ' HB ' HD12 ' A' ' 35' ' ' LEU . 20.6 mm -145.33 140.17 22.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 74.12 111.133 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.5 mtt -143.37 140.55 30.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 73.23 110.848 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 35.5 m-20 -88.54 -169.88 2.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 64.13 110.861 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -61.13 2.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.179 -0.464 . . . . 53.33 110.867 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.26 -57.29 9.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 74.32 110.846 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.04 -58.25 6.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 70.33 110.866 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.8 t -53.48 -42.2 67.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 71.31 110.844 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -57.46 -45.02 85.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.146 -0.479 . . . . 72.14 110.866 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.03 -61.71 2.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 63.45 111.114 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.429 ' CZ ' HG11 ' A' ' 57' ' ' VAL . 15.8 t80 -52.6 -48.59 66.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 75.51 110.779 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.436 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -61.52 -48.9 78.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.245 -0.434 . . . . 72.25 110.878 179.959 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.79 -43.27 62.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.236 -0.438 . . . . 62.54 111.128 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.742 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.7 mt-30 -68.76 -66.6 0.55 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 50.13 110.945 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.436 HG22 ' HA ' ' A' ' 54' ' ' MET . 15.0 m -47.5 -36.71 4.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.13 -0.486 . . . . 74.13 111.113 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 mmmt -67.02 -55.96 12.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 73.22 110.906 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.29 -53.05 23.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 72.22 111.145 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.613 ' O ' HG13 ' A' ' 64' ' ' VAL . 0.2 OUTLIER -62.85 -48.53 78.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 72.14 110.965 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -50.25 -38.47 40.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.126 -0.488 . . . . 72.02 110.855 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.67 -53.67 12.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.139 -0.482 . . . . 75.13 111.103 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.1 -26.95 63.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.152 -0.477 . . . . 54.3 110.864 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.613 HG13 ' O ' ' A' ' 60' ' ' PHE . 9.0 m -93.87 -19.56 6.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 72.4 111.109 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 74.22 110.887 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 16.8 m . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.855 0.359 . . . . 73.32 111.135 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.548 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -100.81 159.91 28.24 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.542 0.687 . . . . 43.12 111.132 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.74 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.3 Cg_endo -69.7 -6.78 19.4 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.657 2.238 . . . . 72.52 112.339 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -92.34 -40.24 11.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.271 -0.422 . . . . 71.53 110.841 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -57.77 -60.75 3.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 71.33 110.85 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.74 HD11 ' HA ' ' A' ' 71' ' ' PRO . 0.3 OUTLIER -44.18 -68.46 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.451 . . . . 74.21 111.126 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.3 m -49.03 -39.61 12.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 71.12 111.166 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.4 mtmt -59.42 -38.54 80.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 74.41 110.934 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.443 HG22 ' HB2' ' A' ' 121' ' ' ASP . 98.7 t -71.11 -39.22 73.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 74.5 111.089 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.8 OUTLIER -69.5 -30.59 68.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 54.24 110.918 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.64 -22.31 21.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.853 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -74.14 -50.88 17.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 71.23 110.953 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.852 HD13 HD12 ' A' ' 120' ' ' LEU . 8.1 mt -90.64 12.68 18.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 64.35 110.865 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.43 43.01 29.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 54.04 110.853 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.836 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.3 mm? -78.69 86.28 4.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.125 -0.489 . . . . 70.21 110.91 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.624 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -46.11 156.75 0.14 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.16 -0.473 . . . . 63.52 111.103 179.911 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -59.89 -22.69 62.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 75.24 110.905 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.1 -51.06 10.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 73.01 110.887 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.624 ' H ' HG23 ' A' ' 84' ' ' THR . 0.9 OUTLIER -66.48 -52.75 42.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 64.1 110.843 -179.983 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.509 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -54.95 -32.01 61.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.113 -0.494 . . . . 73.15 111.103 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.4 t -80.44 -35.08 35.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 62.4 110.869 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -76.3 -23.37 54.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 63.23 110.878 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.732 ' CD1' HD12 ' A' ' 127' ' ' LEU . 57.1 mt -102.09 -60.68 2.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.142 -0.481 . . . . 61.13 111.16 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.56 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.8 m-85 -78.51 -63.49 1.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.485 . . . . 75.43 110.903 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 111.32 47.17 0.76 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.8 -0.715 . . . . 44.31 112.466 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -69.21 -46.88 56.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.721 -0.752 . . . . 41.52 112.488 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 111.45 169.53 18.75 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.689 -0.767 . . . . 71.53 112.48 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.682 HG13 ' H ' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -51.22 -66.6 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.912 0.387 . . . . 62.22 111.222 179.992 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.682 ' H ' HG13 ' A' ' 96' ' ' VAL . 31.6 m-80 -86.07 40.67 0.88 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.099 -0.5 . . . . 71.14 110.876 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.76 -73.6 0.1 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 55.14 111.095 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -40.28 -46.21 2.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.465 . . . . 75.24 110.912 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.3 m -56.46 -74.74 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.087 -0.506 . . . . 74.31 110.902 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.522 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 10.1 mtt85 -48.38 -52.79 20.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.08 -0.509 . . . . 64.23 110.867 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.615 ' HB3' HD12 ' A' ' 74' ' ' ILE . 12.0 m-85 -50.76 -36.27 35.91 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.216 -0.447 . . . . 64.35 110.925 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -56.12 -39.7 72.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 74.53 110.862 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.74 -17.64 23.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 61.22 110.948 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.0 27.15 14.33 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.747 -0.74 . . . . 73.05 112.502 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.1 m-20 -96.38 -20.57 18.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.794 0.331 . . . . 71.23 110.911 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.522 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -108.54 17.35 22.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.09 -0.505 . . . . 22.02 111.151 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.483 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.4 tm0? -120.56 54.56 3.7 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.63 0.729 . . . . 71.14 110.935 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.429 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 54.1 Cg_endo -69.77 31.64 0.19 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.686 2.257 . . . . 64.45 112.361 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.696 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.0 m-70 69.02 38.46 0.18 Allowed Pre-proline 0 C--N 1.331 -0.237 0 CA-C-O 121.557 0.694 . . . . 74.34 110.854 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.696 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.5 Cg_endo -69.83 -165.71 0.16 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.619 2.212 . . . . 74.13 112.354 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 12.0 m -83.65 -33.54 25.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.237 -0.438 . . . . 63.14 110.904 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.56 HG23 ' HB3' ' A' ' 92' ' ' PHE . 15.5 m -48.87 -40.79 31.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.107 -0.497 . . . . 73.42 111.174 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.436 HD11 ' CG ' ' A' ' 108' ' ' GLN . 27.2 mm -61.08 -43.8 96.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 62.53 111.183 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.665 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -65.08 -28.91 69.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.084 -0.507 . . . . 73.22 110.843 179.867 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.665 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.5 mp -81.46 -42.98 19.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.231 -0.441 . . . . 74.04 110.911 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.614 HD13 HG22 ' A' ' 74' ' ' ILE . 30.2 mt -62.02 -49.36 76.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.185 -0.461 . . . . 65.23 110.856 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.577 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.6 ptp180 -51.61 -38.48 54.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 60.54 110.886 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.577 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.3 m -89.68 -13.99 9.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.169 -0.469 . . . . 73.22 111.134 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.852 HD12 HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -77.62 -40.82 40.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 72.21 110.89 -179.993 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . 0.443 ' HB2' HG22 ' A' ' 77' ' ' VAL . 7.6 t70 -49.32 -31.98 10.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.199 -0.455 . . . . 72.41 110.926 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.46 -21.2 17.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.147 -0.479 . . . . 73.22 110.884 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.755 ' O ' HD13 ' A' ' 120' ' ' LEU . 31.8 m-70 -127.56 88.21 54.2 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.606 0.717 . . . . 61.53 110.871 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.604 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.1 Cg_endo -69.74 3.53 2.71 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.716 2.277 . . . . 63.34 112.37 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -117.24 -12.69 10.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 74.54 110.937 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.663 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.2 tp -54.11 -46.79 72.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 71.22 110.954 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.732 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.41 -29.68 6.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.489 . . . . 64.0 110.903 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.492 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.27 -28.6 23.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 73.41 110.886 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.426 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -93.18 4.68 53.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.45 . . . . 71.44 110.91 -179.993 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.1 pt -123.81 -35.01 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 75.14 111.14 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.492 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 2.1 ptt-85 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 65.42 110.841 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.673 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 1.3 mmt . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.835 0.35 . . . . 71.03 110.871 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.82 -169.39 0.41 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 75.44 110.846 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.9 p 175.92 58.66 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.614 0.721 . . . . 43.34 110.924 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 1.15 4.67 Favored 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.698 2.265 . . . . 71.42 112.349 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.466 HG21 ' CB ' ' A' ' 42' ' ' GLU . 28.6 m -89.59 -41.97 14.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 73.21 111.213 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.438 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.7 OUTLIER -125.45 -31.37 3.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.152 -0.476 . . . . 61.32 110.896 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 66.6 53.42 0.93 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 72.33 110.85 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 85.7 mm-40 -112.38 -76.08 0.6 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.247 -0.433 . . . . 75.22 110.882 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.91 -109.47 3.27 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.702 -0.761 . . . . 52.11 112.449 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.673 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 7.6 pt-20 -177.46 98.3 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.888 0.375 . . . . 70.42 110.87 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.569 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -55.72 106.56 0.26 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.09 -0.505 . . . . 75.52 110.873 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.1 p -149.16 130.67 5.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 64.13 111.161 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.53 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -45.93 127.98 8.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.433 . . . . 73.31 110.893 -179.843 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.97 79.79 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.707 -0.758 . . . . 74.04 112.491 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.416 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.7 OUTLIER -36.97 146.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.881 0.372 . . . . 74.44 111.092 -179.931 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.58 -168.28 2.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.187 -0.46 . . . . 73.34 110.909 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -93.98 116.21 28.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 75.12 110.889 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.776 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.2 mm -107.98 90.66 6.8 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.572 0.701 . . . . 71.03 111.157 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.514 ' HB3' HG12 ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.75 104.19 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.657 2.238 . . . . 61.1 112.383 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -70.87 -30.97 67.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 63.41 110.926 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.5 HG21 ' HG2' ' A' ' 25' ' ' ARG . 21.6 m -128.21 147.44 50.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 61.12 111.167 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -146.35 30.49 1.02 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 73.4 110.884 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.421 ' HD3' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -118.63 -44.81 2.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.116 -0.493 . . . . 71.45 110.878 -179.873 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -151.22 -58.08 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.774 -0.727 . . . . 64.21 112.473 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.5 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -91.73 45.46 1.23 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.381 . . . . 74.32 110.869 -179.835 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.402 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 9.1 tttm -49.66 110.85 0.42 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 73.32 110.872 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.637 HG21 ' CD1' ' A' ' 60' ' ' PHE . 2.2 t -132.13 93.28 3.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 73.42 111.131 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.514 HG12 ' HB3' ' A' ' 19' ' ' PRO . 0.8 OUTLIER -80.82 139.83 17.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 73.31 111.13 179.924 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.776 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -86.09 63.6 8.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 62.31 110.921 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.0 mttp -42.26 104.55 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 71.22 110.918 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.493 ' O ' HD13 ' A' ' 32' ' ' ILE . . . 117.42 60.49 0.3 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.759 -0.734 . . . . 72.21 112.495 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.593 HD11 ' CB ' ' A' ' 29' ' ' LEU . 18.2 mm -116.78 92.34 2.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.807 0.337 . . . . 61.5 111.135 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.52 156.66 36.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.274 -0.421 . . . . 61.35 110.828 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 164.53 -107.66 0.31 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.713 -0.755 . . . . 52.54 112.464 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.716 HD12 ' HB ' ' A' ' 44' ' ' ILE . 49.8 mt -156.47 83.33 0.98 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.91 0.385 . . . . 71.4 110.916 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.538 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -165.66 168.79 15.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 74.14 110.935 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.1 t -177.06 -35.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 73.4 110.879 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.69 -49.01 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 53.44 111.134 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.79 173.93 7.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 71.53 110.786 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.8 p -147.8 36.3 0.86 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 74.13 110.843 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -112.36 -75.67 0.6 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 54.2 110.913 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.466 ' CB ' HG21 ' A' ' 5' ' ' VAL . 1.8 pm0 -79.06 60.4 2.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 65.02 110.912 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.2 p -83.73 159.48 21.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.463 . . . . 74.12 110.837 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.716 ' HB ' HD12 ' A' ' 35' ' ' LEU . 28.4 mm -142.76 140.65 27.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.056 -0.52 . . . . 74.12 111.123 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.1 mtt -145.66 141.16 27.85 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 73.23 110.88 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.0 m-20 -86.07 -169.93 2.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 64.13 110.908 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 6.6 mmpt? -57.8 -59.62 4.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 53.33 110.878 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.93 -57.76 8.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.26 -0.427 . . . . 74.32 110.925 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.58 -59.03 4.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.19 -0.459 . . . . 70.33 110.882 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.6 t -52.79 -38.22 60.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.134 -0.485 . . . . 71.31 110.871 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.54 -43.24 99.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.096 -0.502 . . . . 72.14 110.902 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.89 -58.78 5.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 63.45 111.073 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.505 ' O ' HG13 ' A' ' 57' ' ' VAL . 15.1 t80 -53.63 -47.64 70.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.251 -0.431 . . . . 75.51 110.937 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -50.98 67.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.117 -0.492 . . . . 72.25 110.877 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.02 -40.57 58.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 62.54 111.071 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.736 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.4 mt-30 -70.29 -67.48 0.49 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 50.13 110.876 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.505 HG13 ' O ' ' A' ' 53' ' ' PHE . 9.3 m -48.01 -34.58 4.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.227 -0.442 . . . . 74.13 111.13 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.3 mmmm -69.19 -56.71 6.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 73.22 110.882 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -48.99 -51.89 28.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.248 -0.433 . . . . 72.22 111.07 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.693 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.2 OUTLIER -62.83 -48.66 78.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.263 -0.426 . . . . 72.14 110.853 -179.875 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.54 -37.57 40.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.494 . . . . 72.02 110.866 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.0 -52.82 15.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 75.13 111.133 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.46 -31.31 67.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 54.3 110.791 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.693 HG22 ' O ' ' A' ' 60' ' ' PHE . 30.9 m -91.45 -16.54 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 72.4 111.087 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 74.22 110.833 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 14.7 m . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.814 0.34 . . . . 73.32 111.166 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.543 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.71 159.39 30.03 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.535 0.684 . . . . 43.12 111.124 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.543 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 54.1 Cg_endo -69.73 -7.81 22.01 Favored 'Trans proline' 0 C--N 1.341 0.132 0 C-N-CA 122.681 2.254 . . . . 72.52 112.367 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -95.77 -38.36 10.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.23 -0.441 . . . . 71.53 110.917 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -55.71 -61.6 2.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.126 -0.488 . . . . 71.33 110.859 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.692 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.42 -68.68 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.165 -0.47 . . . . 74.21 111.094 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.6 m -48.88 -39.03 11.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 71.12 111.149 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -60.82 -38.52 85.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 74.41 110.966 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.479 HG22 ' HB2' ' A' ' 121' ' ' ASP . 97.3 t -70.63 -38.29 72.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.455 . . . . 74.5 111.111 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 78' ' ' ARG . 1.1 mtp180 -69.58 -32.63 71.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 54.24 110.85 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.57 -18.97 24.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 74.11 110.877 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.463 ' HG2' HD23 ' A' ' 81' ' ' LEU . 2.0 ttmt -76.1 -51.46 12.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.276 -0.42 . . . . 71.23 110.916 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.817 ' HB2' HD23 ' A' ' 83' ' ' LEU . 8.5 mt -91.39 14.44 14.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 64.35 110.905 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.49 42.91 29.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.464 . . . . 54.04 110.904 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.817 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.3 mm? -78.71 84.36 4.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 70.21 110.895 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.612 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.78 155.92 0.23 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 63.52 111.177 179.918 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -57.82 -22.52 47.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 75.24 110.936 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.17 -53.31 7.1 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.174 -0.467 . . . . 73.01 110.869 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.612 ' H ' HG23 ' A' ' 84' ' ' THR . 4.2 tp10 -64.42 -55.68 19.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 64.1 110.936 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.536 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -51.22 -35.9 39.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 73.15 111.094 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 94.5 p -78.61 -32.24 47.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 62.4 110.82 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -74.62 -28.52 60.92 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.123 -0.49 . . . . 63.23 110.906 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.778 HD12 ' HB3' ' A' ' 131' ' ' ARG . 17.3 mm -99.9 -61.75 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 61.13 111.11 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.537 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.3 m-85 -73.42 -63.46 1.19 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 75.43 110.882 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 117.51 37.94 0.88 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.765 -0.731 . . . . 44.31 112.549 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -57.54 -52.18 53.41 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.782 -0.723 . . . . 41.52 112.463 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.11 -154.49 16.62 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.698 -0.763 . . . . 71.53 112.556 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.6 t -85.14 -67.2 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.882 0.372 . . . . 62.22 111.065 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -82.11 36.18 0.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.443 . . . . 71.14 110.923 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.38 -78.77 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.5 . . . . 55.14 111.076 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -38.09 -43.05 0.71 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 75.24 110.913 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.2 t -57.39 -76.6 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 74.31 110.929 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.562 ' HB3' ' HB2' ' A' ' 107' ' ' ALA . 54.6 mtt180 -50.06 -48.97 52.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.481 . . . . 64.23 110.861 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.498 ' HB3' HD12 ' A' ' 74' ' ' ILE . 8.7 m-85 -52.22 -36.33 51.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.144 -0.48 . . . . 64.35 110.911 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -55.73 -31.67 62.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.065 -0.516 . . . . 74.53 110.876 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.44 -17.21 15.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 61.22 110.899 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.18 26.65 15.44 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.773 -0.727 . . . . 73.05 112.517 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -99.04 -2.82 36.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.848 0.356 . . . . 71.23 110.839 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.562 ' HB2' ' HB3' ' A' ' 101' ' ' ARG . . . -121.95 17.09 10.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 22.02 111.139 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.43 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 0.0 OUTLIER -126.34 55.21 13.0 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.535 0.684 . . . . 71.14 110.871 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.501 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.9 Cg_endo -69.74 39.09 0.27 Allowed 'Trans proline' 0 C--N 1.341 0.135 0 C-N-CA 122.619 2.213 . . . . 64.45 112.424 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.734 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.3 m170 70.96 35.31 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.618 0.723 . . . . 74.34 110.861 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.734 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.5 Cg_endo -69.69 -164.15 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.765 2.31 . . . . 74.13 112.348 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.29 -27.27 22.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 63.14 110.844 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.537 HG23 ' HB3' ' A' ' 92' ' ' PHE . 48.1 m -58.74 -41.28 86.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.078 -0.51 . . . . 73.42 111.161 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.402 HD11 ' HB2' ' A' ' 108' ' ' GLN . 46.3 mm -61.76 -46.31 96.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 62.53 111.13 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.445 ' HZ2' HG11 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -66.45 -29.05 69.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.136 -0.484 . . . . 73.22 110.911 179.869 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.458 ' CD2' HD12 ' A' ' 130' ' ' ILE . 5.7 mp -79.64 -42.35 25.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.192 -0.458 . . . . 74.04 110.845 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.692 HD13 HG22 ' A' ' 74' ' ' ILE . 26.9 mt -62.97 -48.57 78.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 65.23 110.931 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.592 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.3 ptp180 -53.05 -35.2 59.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 60.54 110.884 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.592 HG13 ' HG3' ' A' ' 118' ' ' ARG . 30.6 m -93.45 -12.8 8.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 73.22 111.066 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.744 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -79.02 -39.21 34.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 72.21 110.897 -179.989 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . 0.479 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.6 OUTLIER -50.61 -30.39 13.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.244 -0.435 . . . . 72.41 110.801 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.15 -19.42 17.92 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.204 -0.453 . . . . 73.22 110.89 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.744 ' O ' HD13 ' A' ' 120' ' ' LEU . 46.5 m-70 -130.27 88.29 48.28 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.544 0.687 . . . . 61.53 110.837 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.651 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.3 Cg_endo -69.69 2.57 3.37 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.724 2.283 . . . . 63.34 112.351 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -116.81 -11.52 10.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.225 -0.443 . . . . 74.54 110.925 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.666 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.5 tp -53.87 -46.32 71.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.108 -0.496 . . . . 71.22 110.884 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.514 HD13 HD11 ' A' ' 83' ' ' LEU . 1.7 pt? -49.97 -29.65 8.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.471 . . . . 64.0 110.922 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.507 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.34 -27.8 24.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.448 . . . . 73.41 110.878 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.427 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -93.59 3.69 55.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.185 -0.461 . . . . 71.44 110.914 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.666 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.7 pt -122.6 -34.82 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.496 . . . . 75.14 111.124 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.778 ' HB3' HD12 ' A' ' 91' ' ' ILE . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 65.42 110.833 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.546 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 3.9 mmt . . . . . 0 N--CA 1.458 -0.063 0 CA-C-O 120.841 0.353 . . . . 71.03 110.88 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.7 -169.31 0.42 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 75.44 110.915 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 p 176.73 58.26 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.636 0.731 . . . . 43.34 110.91 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.82 3.66 2.67 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.653 2.235 . . . . 71.42 112.247 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.5 m -95.05 -42.46 12.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.293 -0.412 . . . . 73.21 111.131 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.62 -32.53 3.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 61.32 110.835 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.8 m-70 65.37 49.94 1.81 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.466 . . . . 72.33 110.828 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -111.18 -75.24 0.62 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.442 . . . . 75.22 110.819 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -102.08 -109.51 3.28 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.768 -0.729 . . . . 52.11 112.444 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.546 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 9.4 pt-20 -177.29 98.16 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.852 0.358 . . . . 70.42 110.854 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.573 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -55.78 105.85 0.21 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 75.52 110.845 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.1 p -148.28 129.93 6.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.169 -0.469 . . . . 64.13 111.141 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.548 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -45.69 125.28 5.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 73.31 110.891 -179.863 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -178.0 81.83 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.774 -0.727 . . . . 74.04 112.564 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.408 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -38.15 148.65 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.873 0.368 . . . . 74.44 111.12 -179.955 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.41 -164.84 1.44 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.189 -0.459 . . . . 73.34 110.907 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.664 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -97.2 116.75 29.97 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.243 -0.435 . . . . 75.12 110.867 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.727 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.2 mm -107.65 91.83 7.85 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.671 0.748 . . . . 71.03 111.086 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.423 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.6 Cg_endo -69.82 96.08 0.58 Allowed 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.693 2.262 . . . . 61.1 112.305 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.52 ' HB3' HG23 ' A' ' 27' ' ' THR . 16.3 t80 -60.76 -39.63 89.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.187 -0.461 . . . . 63.41 110.945 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.44 HG22 ' H ' ' A' ' 23' ' ' ARG . 15.7 m -128.41 144.69 51.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.134 -0.484 . . . . 61.12 111.064 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -134.13 45.81 2.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 73.4 110.864 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.44 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -132.57 -68.28 0.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 71.45 110.874 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.83 -46.62 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.712 -0.756 . . . . 64.21 112.513 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.435 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.25 39.71 1.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.86 0.362 . . . . 74.32 110.891 -179.885 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -52.51 118.92 3.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.161 -0.472 . . . . 73.32 110.909 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.52 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -132.55 93.31 3.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.254 -0.43 . . . . 73.42 111.15 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.664 HG11 ' HB2' ' A' ' 17' ' ' ASP . 42.9 t -77.45 126.2 37.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 73.31 111.105 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.743 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.33 51.77 2.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.108 -0.496 . . . . 62.31 110.89 -180.0 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -38.83 107.03 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 71.22 110.937 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.8 45.07 0.39 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.713 -0.756 . . . . 72.21 112.465 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.576 HD11 ' HB3' ' A' ' 29' ' ' LEU . 14.2 mm -106.28 91.0 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.862 0.363 . . . . 61.5 111.118 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.09 158.23 34.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.103 -0.499 . . . . 61.35 110.878 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 164.81 -106.86 0.28 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.762 -0.733 . . . . 52.54 112.497 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.743 HD12 ' HB ' ' A' ' 44' ' ' ILE . 45.6 mt -156.68 82.71 0.96 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.824 0.345 . . . . 71.4 110.924 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.482 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -165.04 168.25 17.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 74.14 110.893 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -175.47 -36.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 73.4 110.868 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.0 -49.06 2.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 53.44 111.108 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.73 175.55 7.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 71.53 110.883 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.8 t -148.73 35.69 0.78 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 74.13 110.881 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -111.84 -75.96 0.6 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.182 -0.463 . . . . 54.2 110.909 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -77.82 60.41 2.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 65.02 110.827 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.5 p -84.34 156.97 21.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.453 . . . . 74.12 110.84 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.743 ' HB ' HD12 ' A' ' 35' ' ' LEU . 26.6 mm -142.96 141.07 27.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 74.12 111.15 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 12.7 mtt -144.63 142.68 30.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.206 -0.452 . . . . 73.23 110.876 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.6 m-20 -88.04 -174.85 4.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.429 . . . . 64.13 110.858 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -59.65 4.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 53.33 110.872 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.66 -58.64 5.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.317 -0.401 . . . . 74.32 110.889 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -49.62 -54.17 19.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.491 . . . . 70.33 110.89 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.1 p -55.71 -44.0 77.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.101 -0.499 . . . . 71.31 110.845 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.74 -43.45 80.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 72.14 110.839 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.1 -63.0 1.21 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.165 -0.47 . . . . 63.45 111.118 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.491 ' O ' HG13 ' A' ' 57' ' ' VAL . 14.5 t80 -51.86 -46.1 64.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 75.51 110.895 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.425 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.69 -49.93 71.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.129 -0.487 . . . . 72.25 110.894 179.913 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.21 -42.38 60.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 62.54 111.059 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.743 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.5 mt-30 -69.87 -66.97 0.52 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.444 . . . . 50.13 110.889 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.9 m -47.31 -35.56 3.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 74.13 111.143 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -69.18 -54.34 15.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 73.22 110.973 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.67 -53.71 22.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 72.22 111.09 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.641 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -62.84 -48.14 80.35 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 72.14 110.881 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.65 -36.72 36.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 72.02 110.886 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.46 -53.62 10.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 75.13 111.07 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.23 -26.66 65.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 54.3 110.9 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 60' ' ' PHE . 17.2 m -96.14 -16.27 7.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.487 . . . . 72.4 111.094 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 74.22 110.931 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 5.6 m . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.876 0.369 . . . . 73.32 111.103 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.4 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -101.21 154.88 36.92 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.575 0.702 . . . . 43.12 111.14 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.782 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.0 Cg_endo -69.77 -5.95 17.44 Favored 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.678 2.252 . . . . 72.52 112.332 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -93.67 -40.57 10.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.211 -0.45 . . . . 71.53 110.917 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.595 ' O ' HG23 ' A' ' 77' ' ' VAL . 19.6 t80 -57.06 -62.04 2.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 71.33 110.902 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.782 HD11 ' HA ' ' A' ' 71' ' ' PRO . 0.3 OUTLIER -39.8 -71.97 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 74.21 111.139 -179.981 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.402 HG23 ' N ' ' A' ' 76' ' ' LYS . 33.3 m -47.57 -38.73 6.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 71.12 111.142 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.402 ' N ' HG23 ' A' ' 75' ' ' VAL . 0.9 OUTLIER -62.82 -42.86 99.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 74.41 110.833 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.595 HG23 ' O ' ' A' ' 73' ' ' PHE . 25.3 t -62.78 -40.01 87.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 74.5 111.144 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.452 HH11 ' HD2' ' A' ' 78' ' ' ARG . 1.3 mtp85 -65.71 -55.03 19.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.444 . . . . 54.24 110.881 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.8 mmtp -66.48 -22.61 66.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 74.11 110.895 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -69.99 -52.98 19.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.464 . . . . 71.23 110.912 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.82 ' HB2' HD23 ' A' ' 83' ' ' LEU . 13.0 mt -89.84 13.63 14.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 64.35 110.908 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 53.65 38.7 28.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 54.04 110.831 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.82 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.6 mm? -78.73 81.75 5.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 70.21 110.919 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.562 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -44.57 156.79 0.07 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.214 -0.448 . . . . 63.52 111.122 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -54.18 -24.71 19.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.16 -0.473 . . . . 75.24 110.849 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.4 mtmt -79.14 -47.54 15.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.218 -0.446 . . . . 73.01 110.926 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.562 ' H ' HG23 ' A' ' 84' ' ' THR . 40.7 tt0 -65.28 -60.04 3.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.279 -0.419 . . . . 64.1 110.774 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.519 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -49.36 -34.92 17.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 73.15 111.085 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 84.9 p -77.78 -32.95 52.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 62.4 110.88 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -75.23 -29.98 60.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 63.23 110.882 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.735 HD12 ' CB ' ' A' ' 131' ' ' ARG . 17.8 mm -98.32 -63.08 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 61.13 111.1 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.562 ' HB3' HG23 ' A' ' 113' ' ' THR . 5.1 m-85 -73.11 -65.54 0.79 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.489 . . . . 75.43 110.896 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 125.21 32.6 0.78 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.719 -0.753 . . . . 44.31 112.459 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -51.92 -53.68 29.0 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.742 -0.742 . . . . 41.52 112.465 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 110.57 -136.23 13.44 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.687 -0.768 . . . . 71.53 112.506 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.24 -73.5 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.872 0.368 . . . . 62.22 111.127 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.64 42.66 0.98 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 71.14 110.889 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -59.7 -70.28 0.17 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.183 -0.462 . . . . 55.14 111.104 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -40.77 -48.78 3.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 75.24 110.88 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.7 m -55.13 -74.32 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 74.31 110.822 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.507 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 78.4 mtt180 -47.44 -55.17 9.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 64.23 110.865 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.651 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.0 m-85 -48.56 -36.57 15.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.178 -0.465 . . . . 64.35 110.917 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -57.1 -41.98 79.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.099 -0.5 . . . . 74.53 110.863 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.39 -15.66 30.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 61.22 110.868 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.42 25.64 23.01 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.735 -0.745 . . . . 73.05 112.519 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -93.68 -22.72 18.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 71.23 110.871 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.507 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -107.03 19.45 20.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.155 -0.475 . . . . 22.02 111.046 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.496 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.0 OUTLIER -121.23 53.42 3.57 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.652 0.739 . . . . 71.14 110.905 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.0 Cg_endo -69.8 28.49 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.683 2.256 . . . . 64.45 112.286 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.711 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.8 m-70 70.38 36.98 0.12 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.566 0.698 . . . . 74.34 110.838 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.711 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.7 Cg_endo -69.68 -165.27 0.15 Allowed 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.727 2.285 . . . . 74.13 112.369 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.7 p -82.04 -33.13 30.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.039 0.447 . . . . 63.14 110.88 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.587 HG22 ' CD1' ' A' ' 117' ' ' LEU . 23.0 m -49.25 -43.02 42.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.028 -0.533 . . . . 73.42 111.179 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.432 HD11 ' CG ' ' A' ' 108' ' ' GLN . 27.2 mm -60.82 -47.08 94.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 62.53 111.144 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.633 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -61.61 -27.7 68.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.145 -0.479 . . . . 73.22 110.942 179.901 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.633 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.4 mp -82.32 -45.64 14.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.203 -0.453 . . . . 74.04 110.848 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.78 HD13 HG22 ' A' ' 74' ' ' ILE . 14.5 mt -57.51 -46.89 83.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.44 . . . . 65.23 110.949 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.589 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.8 ptp180 -55.62 -35.08 65.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.488 . . . . 60.54 110.849 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.589 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.3 m -95.54 -5.37 10.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 73.22 111.157 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.742 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -88.84 -41.06 12.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.11 -0.496 . . . . 72.21 110.882 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -49.93 -31.82 13.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 72.41 110.876 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.11 -19.09 18.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 73.22 110.984 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.742 ' O ' HD13 ' A' ' 120' ' ' LEU . 47.7 m-70 -128.61 88.24 52.73 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.539 0.685 . . . . 61.53 110.83 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.581 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.7 Cg_endo -69.75 2.64 3.35 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.677 2.252 . . . . 63.34 112.357 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -115.73 -13.0 11.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.213 -0.448 . . . . 74.54 110.857 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.657 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.6 tp -54.49 -46.0 73.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.173 -0.467 . . . . 71.22 110.862 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.466 ' HB3' HD11 ' A' ' 120' ' ' LEU . 0.8 OUTLIER -49.18 -30.12 6.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 64.0 110.931 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.456 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.2 m-80 -85.52 -29.93 23.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 73.41 110.935 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.422 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.0 OUTLIER -91.23 4.61 51.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 71.44 110.822 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.657 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.3 pt -124.06 -34.94 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.202 -0.453 . . . . 75.14 111.138 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.735 ' CB ' HD12 ' A' ' 91' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 65.42 110.84 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mtt . . . . . 0 C--O 1.23 0.043 0 CA-C-O 120.837 0.351 . . . . 71.03 110.927 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.4 -169.33 0.44 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 75.44 110.941 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.445 ' O ' ' N ' ' A' ' 7' ' ' HIS . 0.1 OUTLIER 174.88 57.99 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.569 0.7 . . . . 43.34 110.938 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.75 -0.59 7.13 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.649 2.232 . . . . 71.42 112.353 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.479 HG21 ' CD ' ' A' ' 42' ' ' GLU . 29.5 m -90.01 -44.33 14.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.435 . . . . 73.21 111.119 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.457 ' N ' HG23 ' A' ' 5' ' ' VAL . 14.2 p -119.51 -27.65 5.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 61.32 110.88 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.445 ' N ' ' O ' ' A' ' 3' ' ' CYS . 43.6 m-70 62.63 53.67 2.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 72.33 110.868 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -119.41 -75.16 0.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 75.22 110.956 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -98.87 -133.72 8.18 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.668 -0.777 . . . . 52.11 112.51 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.478 ' O ' HG12 ' A' ' 12' ' ' VAL . 6.1 pt-20 -156.06 87.41 1.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.863 0.363 . . . . 70.42 110.926 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.556 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -48.69 105.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 75.52 110.826 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.478 HG12 ' O ' ' A' ' 10' ' ' GLU . 4.2 p -141.85 126.48 16.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 64.13 111.163 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.587 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.3 p -49.27 131.71 19.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 73.31 110.908 -179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.411 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 177.98 80.66 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.805 -0.712 . . . . 74.04 112.481 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.411 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -37.08 146.9 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.882 0.372 . . . . 74.44 111.106 -179.985 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.24 -165.1 1.51 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 73.34 110.9 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.64 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -95.64 117.21 30.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.268 -0.424 . . . . 75.12 110.89 179.857 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.727 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.2 mm -107.79 91.23 7.22 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.62 0.724 . . . . 71.03 111.124 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 96.15 0.58 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.685 2.257 . . . . 61.1 112.364 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.549 ' HB3' HG23 ' A' ' 27' ' ' THR . 6.5 t80 -60.96 -35.83 77.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 63.41 110.934 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.435 HG21 ' HG2' ' A' ' 25' ' ' ARG . 6.4 m -132.37 144.38 50.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 61.12 111.187 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -133.58 45.77 2.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 73.4 110.915 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.416 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -132.45 -68.46 0.61 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.085 -0.507 . . . . 71.45 110.832 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.52 -47.31 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.749 -0.739 . . . . 64.21 112.529 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.435 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.24 40.8 1.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.797 0.332 . . . . 74.32 110.856 -179.893 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.2 tttm -53.92 117.64 3.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.189 -0.46 . . . . 73.32 110.92 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.549 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -130.07 92.85 3.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 73.42 111.134 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.64 HG11 ' HB2' ' A' ' 17' ' ' ASP . 40.7 t -77.31 125.88 37.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 73.31 111.115 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.734 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.84 51.55 2.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 62.31 110.889 179.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.9 mttm -37.94 108.06 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 71.22 110.923 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.66 47.08 0.42 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.738 -0.744 . . . . 72.21 112.527 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.581 HD11 ' HB3' ' A' ' 29' ' ' LEU . 14.8 mm -107.99 90.95 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.856 0.36 . . . . 61.5 111.113 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.89 154.14 39.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 61.35 110.839 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 168.25 -109.37 0.34 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.716 -0.754 . . . . 52.54 112.478 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.749 HD12 ' HB ' ' A' ' 44' ' ' ILE . 58.4 mt -156.89 86.86 0.98 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.815 0.34 . . . . 71.4 110.894 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -159.44 160.19 34.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 74.14 110.963 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 32.2 t -171.85 -39.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.162 -0.472 . . . . 73.4 110.918 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.409 HG13 ' N ' ' A' ' 39' ' ' HIS . 2.6 p -123.26 -46.6 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.121 -0.49 . . . . 53.44 111.045 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.409 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -91.82 171.03 9.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.23 -0.441 . . . . 71.53 110.846 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.84 19.8 2.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 74.13 110.892 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -110.27 -63.13 1.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.255 -0.43 . . . . 54.2 110.876 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.479 ' CD ' HG21 ' A' ' 5' ' ' VAL . 13.1 tp10 -76.87 61.94 2.0 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.124 -0.489 . . . . 65.02 110.914 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.7 p -95.42 154.81 17.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.078 -0.51 . . . . 74.12 110.846 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.749 ' HB ' HD12 ' A' ' 35' ' ' LEU . 18.2 mm -142.41 139.48 29.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 74.12 111.135 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.6 mtt -141.62 145.22 34.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 73.23 110.901 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.0 m-20 -90.55 -170.51 2.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 64.13 110.873 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.24 -61.08 2.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 53.33 110.853 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -51.49 -57.43 9.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 74.32 110.878 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.29 -58.67 5.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 70.33 110.875 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.7 t -52.18 -43.94 64.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 71.31 110.873 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.92 -44.02 81.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.119 -0.491 . . . . 72.14 110.895 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.46 -63.19 1.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 63.45 111.045 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.482 ' O ' HG13 ' A' ' 57' ' ' VAL . 14.4 t80 -51.63 -47.42 63.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.288 -0.414 . . . . 75.51 110.927 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.427 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.37 -49.37 75.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 72.25 110.844 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.52 -43.11 62.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.258 -0.428 . . . . 62.54 111.153 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.734 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.6 mt-30 -69.28 -66.73 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 50.13 110.875 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.482 HG13 ' O ' ' A' ' 53' ' ' PHE . 11.4 m -47.27 -37.02 4.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.277 -0.42 . . . . 74.13 111.058 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -67.17 -54.79 17.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 73.22 110.829 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.32 -52.32 28.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.441 . . . . 72.22 111.084 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.718 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -64.83 -50.08 68.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.281 -0.418 . . . . 72.14 110.818 -179.912 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.41 -34.99 26.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 72.02 110.881 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.26 -56.19 5.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 75.13 111.066 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.89 -32.21 52.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 54.3 110.81 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.718 HG22 ' O ' ' A' ' 60' ' ' PHE . 34.3 m -89.03 -24.79 5.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.165 -0.47 . . . . 72.4 111.131 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.169 -0.469 . . . . 74.22 110.877 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 16.0 m . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.88 0.371 . . . . 73.32 111.159 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.567 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.2 160.15 27.21 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.535 0.683 . . . . 43.12 111.079 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.567 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.7 Cg_endo -69.79 -8.2 22.99 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.634 2.222 . . . . 72.52 112.324 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.41 -37.46 10.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 71.53 110.924 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -55.94 -59.42 4.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 71.33 110.835 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.748 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -46.27 -69.32 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.18 -0.464 . . . . 74.21 111.139 -179.973 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.3 m -47.54 -38.02 5.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 71.12 111.145 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -61.59 -45.2 95.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.485 . . . . 74.41 110.916 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.648 HG22 ' HB2' ' A' ' 121' ' ' ASP . 72.6 t -63.03 -38.92 83.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.444 . . . . 74.5 111.134 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.483 HH22 HG21 ' A' ' 113' ' ' THR . 0.1 OUTLIER -64.23 -54.79 27.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 54.24 110.892 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.99 -21.61 64.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 74.11 110.909 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -70.11 -53.69 16.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 71.23 110.896 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.824 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.6 mt -90.89 13.88 15.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 64.35 110.896 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 52.64 38.64 26.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 54.04 110.819 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.824 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.8 mm? -79.01 86.48 4.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.137 -0.483 . . . . 70.21 110.909 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.651 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.82 156.74 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 63.52 111.175 179.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -56.88 -22.07 34.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 75.24 110.937 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.63 -52.42 7.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 73.01 110.903 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.651 ' H ' HG23 ' A' ' 84' ' ' THR . 4.1 tp10 -58.93 -55.38 35.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 64.1 110.919 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.449 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -50.85 -31.64 17.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.49 . . . . 73.15 111.067 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 7.5 p -80.97 -32.13 34.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.435 . . . . 62.4 110.899 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.77 -21.82 54.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.075 -0.511 . . . . 63.23 110.887 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.751 HD12 ' HB3' ' A' ' 131' ' ' ARG . 22.4 mm -107.37 -61.71 2.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.47 . . . . 61.13 111.082 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.566 ' HB3' HG23 ' A' ' 113' ' ' THR . 4.5 m-85 -75.91 -64.04 1.17 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 75.43 110.852 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 116.49 49.21 0.44 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.763 -0.732 . . . . 44.31 112.443 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -72.03 -36.72 60.58 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.743 -0.741 . . . . 41.52 112.516 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.03 -123.52 7.15 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.727 -0.749 . . . . 71.53 112.474 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.489 HG22 ' N ' ' A' ' 97' ' ' ASN . 0.1 OUTLIER -120.46 -62.03 2.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 62.22 111.1 -179.986 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.489 ' N ' HG22 ' A' ' 96' ' ' VAL . 12.8 p30 -85.61 39.94 0.82 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 71.14 110.914 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.425 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -60.74 -77.54 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 55.14 111.068 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.425 ' C ' ' O ' ' A' ' 98' ' ' ALA . 54.7 m-85 -35.91 -46.74 0.48 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 75.24 110.884 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -57.35 -76.4 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 74.31 110.865 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.53 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 8.9 mtt180 -47.92 -52.73 18.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 64.23 110.865 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.632 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.6 m-85 -49.04 -38.62 24.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 64.35 110.949 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -52.79 -41.33 64.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.087 -0.506 . . . . 74.53 110.854 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.79 -17.24 24.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 61.22 110.977 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 94.08 25.51 16.78 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.757 -0.735 . . . . 73.05 112.505 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -92.89 -23.37 18.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.882 0.373 . . . . 71.23 110.938 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.53 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -103.86 17.22 24.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 22.02 111.079 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.499 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.9 OUTLIER -120.3 55.02 3.72 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.605 0.717 . . . . 71.14 110.98 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 54.1 Cg_endo -69.66 27.6 0.17 Allowed 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.633 2.222 . . . . 64.45 112.396 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.718 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.8 m-70 70.34 37.17 0.13 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.595 0.712 . . . . 74.34 110.869 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.718 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.5 Cg_endo -69.75 -165.25 0.15 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.67 2.247 . . . . 74.13 112.306 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 31.8 m -83.27 -33.44 26.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 63.14 110.818 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.566 HG23 ' HB3' ' A' ' 92' ' ' PHE . 23.9 m -49.09 -41.66 36.35 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.116 -0.493 . . . . 73.42 111.141 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.446 HD11 ' HG2' ' A' ' 108' ' ' GLN . 25.1 mm -60.6 -44.16 96.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.266 -0.425 . . . . 62.53 111.1 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.635 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -64.28 -29.18 70.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 73.22 110.927 179.87 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.635 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.4 mp -81.23 -43.24 19.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 74.04 110.937 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.748 HD13 HG22 ' A' ' 74' ' ' ILE . 18.5 mt -60.5 -49.06 79.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.228 -0.442 . . . . 65.23 110.939 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.565 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.2 ptp180 -52.86 -38.52 61.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 60.54 110.843 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.565 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.4 m -89.86 -11.08 10.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 73.22 111.094 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.768 HD12 HD13 ' A' ' 81' ' ' LEU . 0.5 OUTLIER -81.6 -39.87 23.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.206 -0.452 . . . . 72.21 110.925 179.927 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . 0.648 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.4 OUTLIER -50.85 -30.38 14.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 72.41 110.832 179.9 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -98.3 -18.3 18.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 73.22 110.956 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.752 ' O ' HD13 ' A' ' 120' ' ' LEU . 59.7 m-70 -130.56 88.69 46.15 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.615 0.721 . . . . 61.53 110.879 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.695 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.2 Cg_endo -69.77 2.61 3.38 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.707 2.272 . . . . 63.34 112.367 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -116.44 -12.22 11.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 74.54 110.859 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.657 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.5 tp -54.22 -46.64 72.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 71.22 110.862 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.486 HD13 HD11 ' A' ' 83' ' ' LEU . 1.3 pt? -49.36 -29.59 6.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 64.0 110.901 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.49 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.0 m-80 -86.16 -29.29 23.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.224 -0.444 . . . . 73.41 110.864 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.426 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -92.29 4.68 52.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 71.44 110.946 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.657 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.1 pt -124.04 -34.95 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.099 -0.501 . . . . 75.14 111.143 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.751 ' HB3' HD12 ' A' ' 91' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 65.42 110.899 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mmt . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.818 0.342 . . . . 71.03 110.822 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.78 -170.73 0.5 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 75.44 110.859 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 1.7 p 178.05 56.22 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.53 0.681 . . . . 43.34 110.794 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.405 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 55.2 Cg_endo -69.72 -8.83 24.6 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.699 2.266 . . . . 71.42 112.37 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.67 HG21 ' CD ' ' A' ' 42' ' ' GLU . 6.0 m -67.21 -49.98 67.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 73.21 111.115 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.464 ' N ' HG23 ' A' ' 5' ' ' VAL . 1.2 m -133.2 -21.1 2.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.093 -0.503 . . . . 61.32 110.845 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 66.91 88.96 0.1 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.253 -0.431 . . . . 72.33 110.87 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.636 HE21 ' N ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -132.34 -66.57 0.69 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.249 -0.432 . . . . 75.22 110.933 -179.895 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -127.37 -92.9 0.8 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.814 -0.707 . . . . 52.11 112.529 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 178.34 91.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.838 0.351 . . . . 70.42 110.845 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.57 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.0 OUTLIER -57.23 99.65 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 75.52 110.865 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -139.7 128.95 28.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 64.13 111.152 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.619 ' N ' HD23 ' A' ' 35' ' ' LEU . 42.3 m -48.87 130.44 18.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.182 -0.463 . . . . 73.31 110.852 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.404 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 177.49 82.13 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.658 -0.782 . . . . 74.04 112.471 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.428 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.7 OUTLIER -37.59 147.17 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.881 0.372 . . . . 74.44 111.118 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.56 -168.61 2.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.454 . . . . 73.34 110.886 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.712 ' HB3' HG21 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -95.02 113.6 25.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 75.12 110.868 179.874 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.758 ' O ' HD22 ' A' ' 29' ' ' LEU . 5.7 mm -106.67 88.5 3.5 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.609 0.719 . . . . 71.03 111.125 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.526 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 54.1 Cg_endo -69.75 99.52 0.75 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.699 2.266 . . . . 61.1 112.374 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -65.07 -32.47 74.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.279 -0.419 . . . . 63.41 110.917 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.544 HG21 ' HG2' ' A' ' 25' ' ' ARG . 23.5 m -130.68 147.83 52.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.129 -0.487 . . . . 61.12 111.098 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -147.7 35.14 0.85 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 73.4 110.864 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.424 ' HD3' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -122.48 -43.0 2.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 71.45 110.926 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -154.56 -52.96 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.741 -0.742 . . . . 64.21 112.504 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.544 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -96.51 44.77 1.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.856 0.36 . . . . 74.32 110.886 -179.86 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.427 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 9.9 tttm -50.11 118.39 2.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 73.32 110.903 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.403 ' O ' HG23 ' A' ' 27' ' ' THR . 2.0 t -136.46 82.88 1.97 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 73.42 111.157 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.712 HG21 ' HB3' ' A' ' 17' ' ' ASP . 1.7 p -73.96 133.82 30.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.201 -0.454 . . . . 73.31 111.186 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.781 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.2 OUTLIER -84.41 53.73 2.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 62.31 110.894 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.403 ' C ' ' O ' ' A' ' 29' ' ' LEU . 13.8 mttm -37.07 105.88 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 71.22 110.895 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.47 50.8 0.36 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.736 -0.745 . . . . 72.21 112.527 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.647 HD11 ' CB ' ' A' ' 29' ' ' LEU . 22.9 mm -107.36 96.53 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.817 0.341 . . . . 61.5 111.115 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -77.57 153.26 33.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 61.35 110.825 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.19 -108.43 0.31 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.745 -0.74 . . . . 52.54 112.545 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.734 HD12 ' HB ' ' A' ' 44' ' ' ILE . 48.4 mt -156.88 85.8 0.97 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.858 0.361 . . . . 71.4 110.892 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.534 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -162.3 164.54 27.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 74.14 110.95 179.956 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 43.0 t -168.31 -38.76 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.145 -0.48 . . . . 73.4 110.9 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.1 m -128.44 -45.63 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 53.44 111.18 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.02 169.28 11.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 71.53 110.889 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 10.6 p -134.93 7.38 3.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.223 -0.444 . . . . 74.13 110.849 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -94.55 -65.02 1.01 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 54.2 110.921 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.67 ' CD ' HG21 ' A' ' 5' ' ' VAL . 13.4 tp10 -76.49 61.56 1.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.101 -0.5 . . . . 65.02 110.885 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.3 p -99.92 158.31 15.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.091 -0.504 . . . . 74.12 110.887 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.734 ' HB ' HD12 ' A' ' 35' ' ' LEU . 23.9 mm -142.37 140.18 29.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.491 . . . . 74.12 111.139 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.3 mtm -145.14 132.04 20.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 73.23 110.837 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 -84.91 -170.42 3.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.443 . . . . 64.13 110.845 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -55.22 32.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 53.33 110.985 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.38 -55.57 33.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.181 -0.463 . . . . 74.32 110.836 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -52.29 -60.83 2.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 70.33 110.892 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.7 t -54.71 -38.03 66.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 71.31 110.876 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -59.15 -45.7 90.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.126 -0.488 . . . . 72.14 110.869 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.48 -57.94 7.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 63.45 111.057 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.49 ' O ' HG13 ' A' ' 57' ' ' VAL . 14.1 t80 -54.16 -46.99 72.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 75.51 110.92 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.425 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -64.57 -50.27 67.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.14 -0.482 . . . . 72.25 110.879 179.976 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.22 -40.64 59.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 62.54 111.066 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.781 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.6 mt-30 -71.02 -67.51 0.5 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.452 . . . . 50.13 110.921 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.556 HG12 HD21 ' A' ' 29' ' ' LEU . 12.4 m -47.24 -35.19 3.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.179 -0.464 . . . . 74.13 111.15 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -70.97 -51.26 26.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 73.22 110.897 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.77 -49.43 62.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.263 -0.426 . . . . 72.22 111.124 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.65 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.4 OUTLIER -67.0 -48.09 69.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 72.14 110.808 -179.913 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.12 -50.12 49.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 72.02 110.899 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.62 -54.37 32.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 75.13 111.066 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.87 -38.81 37.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 54.3 110.881 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 60' ' ' PHE . 37.2 t -81.86 -25.47 9.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 72.4 111.104 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.411 ' HB2' ' HA ' ' A' ' 109' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 74.22 110.852 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 11.5 m . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 120.824 0.345 . . . . 73.32 111.135 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.547 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -105.41 159.86 28.02 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.624 0.726 . . . . 43.12 111.101 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.594 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.8 Cg_endo -69.75 -7.14 20.31 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.678 2.252 . . . . 72.52 112.379 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.98 -37.98 11.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.219 -0.446 . . . . 71.53 110.892 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -57.51 -61.61 2.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 71.33 110.879 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.8 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.87 -67.32 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 74.21 111.099 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.0 m -49.3 -39.12 12.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 71.12 111.099 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -60.88 -45.72 93.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 74.41 110.898 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.538 HG22 ' HB2' ' A' ' 121' ' ' ASP . 76.7 t -61.33 -39.12 81.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 74.5 111.167 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.54 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -64.08 -59.34 4.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 54.24 110.915 179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -22.72 67.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.926 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -69.21 -53.13 21.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 71.23 110.905 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.806 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.6 mt -90.69 12.95 17.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 64.35 110.931 179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 54.54 37.51 28.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.429 . . . . 54.04 110.871 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.806 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.8 mm? -80.02 87.11 5.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.109 -0.496 . . . . 70.21 110.899 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.648 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.77 157.17 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 63.52 111.142 179.961 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -57.6 -21.33 38.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 75.24 110.948 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.0 mmtp -81.3 -49.89 10.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.442 . . . . 73.01 110.914 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.648 ' H ' HG23 ' A' ' 84' ' ' THR . 7.2 tp10 -62.31 -52.36 63.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.436 . . . . 64.1 110.913 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.76 -36.49 67.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 73.15 111.084 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 30.6 t -79.18 -26.34 42.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 62.4 110.856 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -81.15 -27.69 35.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 63.23 110.883 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.732 HD12 ' HB3' ' A' ' 131' ' ' ARG . 26.5 mm -101.11 -59.09 3.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.116 -0.493 . . . . 61.13 111.172 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.596 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.7 m-85 -75.7 -61.29 1.97 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 75.43 110.878 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.32 48.98 0.78 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.754 -0.736 . . . . 44.31 112.471 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.61 -38.91 31.12 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.737 -0.744 . . . . 41.52 112.499 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 106.98 165.56 22.28 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.749 -0.738 . . . . 71.53 112.52 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.5 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.8 p -51.4 -51.39 24.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.896 0.379 . . . . 62.22 111.135 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.5 ' N ' HG13 ' A' ' 96' ' ' VAL . 9.0 t30 -87.24 39.17 0.85 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 71.14 110.866 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.7 -76.28 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 55.14 111.108 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -43.41 -39.72 3.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.439 . . . . 75.24 110.91 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 38.9 t -59.95 -75.57 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 74.31 110.818 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.624 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 36.2 mtt180 -50.61 -45.21 57.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 64.23 110.829 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.723 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.4 m-85 -56.25 -36.67 68.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.268 -0.423 . . . . 64.35 110.932 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -52.13 -28.99 19.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.122 -0.49 . . . . 74.53 110.854 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.77 -22.63 12.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.203 -0.453 . . . . 61.22 110.862 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.92 27.19 9.07 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.772 -0.727 . . . . 73.05 112.498 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -98.13 -6.62 31.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.791 0.329 . . . . 71.23 110.879 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.624 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -110.33 10.15 23.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 22.02 111.126 179.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.577 ' HB2' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -125.14 57.27 15.79 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.598 0.714 . . . . 71.14 110.947 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.533 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.2 Cg_endo -69.82 36.68 0.24 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.671 2.247 . . . . 64.45 112.341 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.775 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.7 OUTLIER 73.9 32.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.554 0.693 . . . . 74.34 110.835 179.918 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.775 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.6 Cg_endo -69.74 -163.99 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.764 2.31 . . . . 74.13 112.322 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.4 p -86.65 -29.4 22.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.435 . . . . 63.14 110.84 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.599 HG22 HD12 ' A' ' 117' ' ' LEU . 34.5 m -53.41 -50.76 64.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.089 -0.505 . . . . 73.42 111.112 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.577 HD11 ' HB2' ' A' ' 108' ' ' GLN . 43.3 mm -51.34 -42.5 27.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.264 -0.425 . . . . 62.53 111.136 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.541 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -67.98 -29.86 69.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.225 -0.443 . . . . 73.22 110.868 179.838 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.541 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.7 mp -79.11 -41.64 28.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.277 -0.42 . . . . 74.04 110.886 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.8 HD13 HG22 ' A' ' 74' ' ' ILE . 14.8 mt -64.32 -49.27 72.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.149 -0.478 . . . . 65.23 110.962 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.595 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.3 ptp180 -51.92 -34.94 43.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 60.54 110.886 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.595 HG13 ' HG3' ' A' ' 118' ' ' ARG . 29.5 m -93.57 -14.74 8.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 73.22 111.194 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.769 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -76.05 -39.33 55.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 72.21 110.966 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . 0.538 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.9 OUTLIER -50.67 -30.52 13.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.227 -0.442 . . . . 72.41 110.859 179.793 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -96.72 -20.01 18.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 73.22 110.886 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.769 ' O ' HD13 ' A' ' 120' ' ' LEU . 65.6 m-70 -131.21 90.05 39.76 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 121.619 0.723 . . . . 61.53 110.881 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.725 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.0 Cg_endo -69.69 -0.07 6.32 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.758 2.305 . . . . 63.34 112.345 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -113.48 -11.92 13.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.216 -0.447 . . . . 74.54 110.902 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.683 ' O ' HG23 ' A' ' 130' ' ' ILE . 6.3 tp -53.81 -47.78 70.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.149 -0.478 . . . . 71.22 110.845 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.739 HD13 HD11 ' A' ' 83' ' ' LEU . 2.1 pt? -51.1 -28.95 11.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 64.0 110.934 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.492 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.73 -26.05 24.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 73.41 110.869 179.929 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.411 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.0 OUTLIER -96.02 3.52 53.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 71.44 110.86 -179.978 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.683 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.7 pt -122.41 -34.49 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 75.14 111.207 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.732 ' HB3' HD12 ' A' ' 91' ' ' ILE . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 65.42 110.875 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.543 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 3.1 mmt . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.843 0.354 . . . . 71.03 110.919 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.7 -169.61 0.43 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.429 . . . . 75.44 110.903 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 p 176.92 57.84 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.677 0.751 . . . . 43.34 110.872 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 3.71 2.62 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.679 2.253 . . . . 71.42 112.332 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.2 m -95.66 -42.46 12.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 73.21 111.143 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.38 -32.69 3.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.15 -0.477 . . . . 61.32 110.831 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 65.35 51.02 1.64 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 72.33 110.851 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 94.8 mm-40 -114.59 -75.42 0.59 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 75.22 110.9 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -99.18 -112.43 3.3 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.79 -0.719 . . . . 52.11 112.526 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.543 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 8.0 pt-20 -175.81 97.12 0.07 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.81 0.338 . . . . 70.42 110.92 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.566 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.4 ptp -55.64 106.14 0.23 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 75.52 110.895 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.3 p -148.63 129.61 5.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.218 -0.446 . . . . 64.13 111.16 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.53 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -45.3 125.21 5.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 73.31 110.844 -179.84 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.9 82.17 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.759 -0.734 . . . . 74.04 112.488 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.407 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -38.34 148.87 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.864 0.364 . . . . 74.44 111.133 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.47 -164.74 1.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 73.34 110.9 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.657 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -97.4 116.66 30.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.211 -0.449 . . . . 75.12 110.871 179.86 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.722 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.4 mm -107.56 91.78 7.65 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.607 0.718 . . . . 71.03 111.158 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.422 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.6 Cg_endo -69.7 95.81 0.56 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.751 2.301 . . . . 61.1 112.379 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.504 ' HB3' HG23 ' A' ' 27' ' ' THR . 15.5 t80 -60.18 -40.39 89.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.0 0.428 . . . . 63.41 110.875 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.457 HG21 ' HG2' ' A' ' 25' ' ' ARG . 14.6 m -127.83 145.23 51.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 61.12 111.159 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -134.25 45.09 2.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 73.4 110.872 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.447 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -131.99 -68.44 0.63 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 71.45 110.865 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.35 -47.0 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.798 -0.715 . . . . 64.21 112.541 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.457 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.15 39.83 1.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.813 0.34 . . . . 74.32 110.852 -179.867 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.8 tttm -52.96 117.92 3.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 73.32 110.904 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.504 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.8 t -131.41 93.98 3.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 73.42 111.139 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.657 HG11 ' HB2' ' A' ' 17' ' ' ASP . 42.0 t -77.78 126.05 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.441 . . . . 73.31 111.147 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.722 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.3 OUTLIER -84.28 52.42 2.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.153 -0.476 . . . . 62.31 110.966 -179.989 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -39.19 106.92 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 71.22 110.901 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.88 45.6 0.37 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.698 -0.763 . . . . 72.21 112.437 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.57 HD11 ' HB3' ' A' ' 29' ' ' LEU . 14.3 mm -106.66 90.35 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.829 0.347 . . . . 61.5 111.118 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.54 158.57 34.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 61.35 110.888 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 164.42 -106.58 0.28 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.782 -0.723 . . . . 52.54 112.513 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.759 HD12 ' HB ' ' A' ' 44' ' ' ILE . 47.7 mt -156.63 82.65 0.96 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.839 0.352 . . . . 71.4 110.926 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.474 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -165.66 169.03 15.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.454 . . . . 74.14 110.932 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -176.6 -35.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 73.4 110.927 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -123.52 -45.94 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 53.44 111.071 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -95.33 176.44 6.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.128 -0.487 . . . . 71.53 110.844 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.4 p -148.54 30.71 0.82 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.19 -0.459 . . . . 74.13 110.885 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -105.14 -76.32 0.61 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 54.2 110.9 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -78.28 60.27 2.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 65.02 110.869 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.2 p -84.23 157.82 21.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 74.12 110.879 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.759 ' HB ' HD12 ' A' ' 35' ' ' LEU . 24.8 mm -143.81 140.91 25.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 74.12 111.139 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.7 mtt -143.8 145.43 32.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.066 -0.516 . . . . 73.23 110.857 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 41.7 m-20 -91.52 -169.97 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 64.13 110.83 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.69 -60.73 3.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 53.33 110.892 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -51.19 -57.41 8.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 74.32 110.908 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.02 -57.92 7.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.11 -0.496 . . . . 70.33 110.915 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.0 t -53.46 -42.17 66.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.124 -0.489 . . . . 71.31 110.853 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -57.6 -44.67 85.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 72.14 110.878 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.76 -61.51 2.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 63.45 111.155 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.494 ' O ' HG13 ' A' ' 57' ' ' VAL . 15.3 t80 -52.32 -47.29 66.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 75.51 110.848 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.426 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.2 -49.6 73.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 72.25 110.835 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.44 -42.27 61.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.256 -0.429 . . . . 62.54 111.127 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.717 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.5 mt-30 -69.96 -66.67 0.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 50.13 110.886 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.494 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.0 m -47.45 -35.63 4.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.434 . . . . 74.13 111.167 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -69.04 -54.58 14.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 73.22 110.857 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.7 -54.35 19.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 72.22 111.105 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.551 ' O ' HG13 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -61.79 -48.91 78.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 72.14 110.928 -179.941 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.47 -39.44 33.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 72.02 110.839 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.52 -54.33 12.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 75.13 111.096 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.24 -31.39 63.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 54.3 110.826 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.551 HG13 ' O ' ' A' ' 60' ' ' PHE . 11.2 m -88.18 -22.51 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 72.4 111.175 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 74.22 110.859 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.444 HG21 HG23 ' A' ' 114' ' ' ILE . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.848 0.356 . . . . 73.32 111.091 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.414 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -78.99 155.63 77.43 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.621 0.724 . . . . 43.12 111.107 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.648 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.9 Cg_endo -69.62 -6.93 19.72 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.736 2.29 . . . . 72.52 112.347 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.17 -36.69 9.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 71.53 110.917 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.583 ' O ' HG23 ' A' ' 77' ' ' VAL . 21.7 t80 -59.06 -61.72 2.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.495 . . . . 71.33 110.856 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.844 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -39.43 -69.62 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 74.21 111.134 179.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.418 HG23 ' N ' ' A' ' 76' ' ' LYS . 35.7 m -49.54 -40.01 14.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.093 -0.503 . . . . 71.12 111.168 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.418 ' N ' HG23 ' A' ' 75' ' ' VAL . 25.2 mtmt -60.92 -45.12 95.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 74.41 110.933 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 73' ' ' PHE . 21.9 t -60.83 -39.79 83.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.146 -0.479 . . . . 74.5 111.086 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.464 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -63.98 -59.55 4.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 54.24 110.909 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt -63.05 -22.85 67.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 74.11 110.895 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -68.92 -52.95 24.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 71.23 110.84 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.693 HD22 ' HB3' ' A' ' 124' ' ' PRO . 11.7 mt -91.12 13.1 17.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.245 -0.434 . . . . 64.35 110.906 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.2 m 55.35 38.34 30.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.447 . . . . 54.04 110.837 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.686 HD21 HD13 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -79.54 86.67 5.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 70.21 110.92 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.637 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.53 157.23 0.15 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.482 . . . . 63.52 111.124 179.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -56.26 -21.74 25.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 75.24 110.911 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -81.97 -48.85 10.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.206 -0.452 . . . . 73.01 110.959 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.637 ' H ' HG23 ' A' ' 84' ' ' THR . 5.5 tp10 -61.89 -56.88 14.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 64.1 110.886 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.405 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -51.78 -38.04 53.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.169 -0.469 . . . . 73.15 111.099 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 27.0 t -77.69 -26.75 50.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 62.4 110.797 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -80.85 -29.21 35.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 63.23 110.868 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.768 HD12 ' HB3' ' A' ' 131' ' ' ARG . 18.2 mm -99.8 -60.95 2.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 61.13 111.106 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.608 ' HB3' HG23 ' A' ' 113' ' ' THR . 7.3 m-85 -72.69 -60.74 2.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 75.43 110.851 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 108.72 46.36 0.97 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.734 -0.746 . . . . 44.31 112.487 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -75.55 -43.78 23.15 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.722 -0.751 . . . . 41.52 112.562 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . 0.412 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 108.34 167.9 21.19 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.77 -0.729 . . . . 71.53 112.502 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.491 HG13 ' N ' ' A' ' 97' ' ' ASN . 3.1 p -52.33 -50.02 39.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.794 0.33 . . . . 62.22 111.172 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.491 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.9 OUTLIER -86.66 37.61 0.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.115 -0.493 . . . . 71.14 110.862 179.951 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.412 ' HB2' ' O ' ' A' ' 95' ' ' GLY . . . -64.6 -75.82 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.449 . . . . 55.14 111.044 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -44.42 -40.46 5.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.259 -0.428 . . . . 75.24 110.857 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.2 m -59.68 -74.76 0.07 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 74.31 110.838 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.617 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 16.3 mtt85 -50.19 -45.77 53.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.075 -0.511 . . . . 64.23 110.85 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.733 ' HB3' HD12 ' A' ' 74' ' ' ILE . 10.5 m-85 -56.09 -36.36 68.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.221 -0.445 . . . . 64.35 110.89 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -51.45 -29.23 15.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.473 . . . . 74.53 110.92 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -108.55 -23.02 12.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 61.22 110.921 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.09 26.54 8.8 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.723 -0.751 . . . . 73.05 112.438 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -96.99 -4.85 39.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.805 0.336 . . . . 71.23 110.888 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.617 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -112.58 8.4 19.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.216 -0.447 . . . . 22.02 111.144 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.515 ' HB2' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -125.2 57.1 15.42 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.577 0.703 . . . . 71.14 110.87 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.54 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.2 Cg_endo -69.82 35.88 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.679 2.253 . . . . 64.45 112.279 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.786 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 1.1 t-80 74.79 31.28 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.644 0.735 . . . . 74.34 110.887 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.786 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.9 Cg_endo -69.78 -163.78 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.707 2.272 . . . . 74.13 112.306 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.14 -29.78 24.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.17 -0.468 . . . . 63.14 110.84 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.608 HG23 ' HB3' ' A' ' 92' ' ' PHE . 21.9 m -53.06 -52.18 59.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 73.42 111.134 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.515 HD11 ' HB2' ' A' ' 108' ' ' GLN . 38.8 mm -51.11 -45.14 30.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 62.53 111.183 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.449 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -65.35 -28.46 69.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 73.22 110.917 179.796 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.519 ' O ' HD23 ' A' ' 120' ' ' LEU . 5.9 mp -79.53 -42.92 24.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 74.04 110.905 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.844 HD13 HG22 ' A' ' 74' ' ' ILE . 7.3 mt -62.03 -47.64 83.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 65.23 110.898 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.587 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.3 ptp180 -54.74 -34.29 62.29 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.192 -0.458 . . . . 60.54 110.903 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.591 HG23 HD23 ' A' ' 126' ' ' LEU . 32.1 m -94.59 -10.13 9.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.164 -0.471 . . . . 73.22 111.083 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.759 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.6 OUTLIER -82.57 -40.19 21.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.197 -0.456 . . . . 72.21 110.924 179.907 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -49.54 -32.79 13.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.452 . . . . 72.41 110.882 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.52 -21.13 19.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 73.22 110.905 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.759 ' O ' HD13 ' A' ' 120' ' ' LEU . 66.5 m-70 -129.83 90.26 43.61 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.58 0.705 . . . . 61.53 110.911 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.693 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.6 Cg_endo -69.71 -0.72 7.28 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.674 2.25 . . . . 63.34 112.358 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -112.2 -12.39 13.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 74.54 110.792 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.689 ' O ' HG23 ' A' ' 130' ' ' ILE . 6.5 tp -53.79 -47.84 70.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.259 -0.428 . . . . 71.22 110.908 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.686 HD13 HD21 ' A' ' 83' ' ' LEU . 2.2 pt? -51.27 -28.67 12.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.212 -0.449 . . . . 64.0 110.905 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.488 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.87 -26.13 24.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 73.41 110.861 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.409 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.0 OUTLIER -95.78 2.99 54.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 71.44 110.912 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.689 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.1 pt -121.79 -34.55 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.138 -0.483 . . . . 75.14 111.117 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.768 ' HB3' HD12 ' A' ' 91' ' ' ILE . 1.7 ptt-85 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.14 -0.482 . . . . 65.42 110.851 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.603 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 6.2 mmt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.827 0.346 . . . . 71.03 110.818 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.65 -170.36 0.48 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 75.44 110.898 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.7 p 177.67 57.54 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.551 0.691 . . . . 43.34 110.92 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 3.58 2.66 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.672 2.248 . . . . 71.42 112.302 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 4.9 m -96.38 -42.69 12.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.289 -0.414 . . . . 73.21 111.172 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -120.54 -33.03 3.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.475 . . . . 61.32 110.922 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 65.29 51.46 1.59 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 72.33 110.906 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 95.5 mm-40 -118.2 -75.42 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 75.22 110.949 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.51 -115.63 2.96 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.688 -0.768 . . . . 52.11 112.475 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.603 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 6.3 pt-20 -174.88 95.38 0.08 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.837 0.351 . . . . 70.42 110.843 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.537 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.2 ptp -54.71 105.99 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.492 . . . . 75.52 110.847 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.4 HG12 ' O ' ' A' ' 10' ' ' GLU . 7.1 p -148.57 129.12 4.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 64.13 111.106 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.536 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -45.22 128.55 7.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.123 -0.49 . . . . 73.31 110.892 -179.87 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.401 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 179.88 80.0 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.791 -0.718 . . . . 74.04 112.509 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.402 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -36.8 145.9 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.876 0.369 . . . . 74.44 111.126 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.23 -167.9 2.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.183 -0.462 . . . . 73.34 110.933 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -94.39 116.18 28.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 75.12 110.861 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.757 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.3 mm -108.03 90.87 7.07 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.594 0.711 . . . . 71.03 111.128 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.49 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 53.0 Cg_endo -69.83 104.07 1.27 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.706 2.27 . . . . 61.1 112.286 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -71.49 -28.47 63.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.16 -0.473 . . . . 63.41 110.889 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.531 HG21 ' HG2' ' A' ' 25' ' ' ARG . 27.4 m -131.31 149.42 52.57 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.059 -0.519 . . . . 61.12 111.14 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.83 41.18 0.76 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.232 -0.44 . . . . 73.4 110.907 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -129.83 -48.45 1.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 71.45 110.927 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -146.34 -49.43 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.743 -0.741 . . . . 64.21 112.533 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.531 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -103.22 46.34 0.92 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.834 0.35 . . . . 74.32 110.797 -179.834 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.434 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 11.3 tttt -49.52 112.14 0.6 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.263 -0.426 . . . . 73.32 110.884 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.507 HG21 ' CG ' ' A' ' 60' ' ' PHE . 2.3 t -132.81 96.11 3.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.242 -0.436 . . . . 73.42 111.182 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.49 ' HA ' ' HA ' ' A' ' 19' ' ' PRO . 0.7 OUTLIER -84.65 140.34 16.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 73.31 111.164 179.928 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.757 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -86.58 63.7 8.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 62.31 110.929 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -42.36 104.39 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 71.22 110.913 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.49 ' O ' HD13 ' A' ' 32' ' ' ILE . . . 117.53 60.47 0.3 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.706 -0.759 . . . . 72.21 112.554 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.589 HD11 ' CB ' ' A' ' 29' ' ' LEU . 18.2 mm -116.63 93.05 2.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.856 0.36 . . . . 61.5 111.117 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.43 157.38 34.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 61.35 110.932 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 163.48 -106.77 0.28 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.769 -0.729 . . . . 52.54 112.533 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.747 HD12 ' HB ' ' A' ' 44' ' ' ILE . 49.6 mt -156.53 83.44 0.97 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.886 0.374 . . . . 71.4 110.966 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.57 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -167.64 169.5 11.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 74.14 110.994 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -178.88 -34.77 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.199 -0.455 . . . . 73.4 110.927 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.5 m -122.28 -44.99 2.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 53.44 111.138 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -98.53 177.45 5.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 71.53 110.862 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 29.0 p -148.47 26.51 0.94 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.209 -0.45 . . . . 74.13 110.911 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.8 mp0 -100.66 -76.75 0.55 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.138 -0.483 . . . . 54.2 110.859 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -78.38 59.54 2.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.076 -0.511 . . . . 65.02 110.923 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.2 p -84.39 159.25 20.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.072 -0.513 . . . . 74.12 110.82 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.747 ' HB ' HD12 ' A' ' 35' ' ' LEU . 28.2 mm -142.81 140.61 27.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.082 -0.508 . . . . 74.12 111.103 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.0 mtm -145.4 135.11 23.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 73.23 110.928 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -81.53 -170.08 2.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.294 -0.412 . . . . 64.13 110.879 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.34 -58.96 5.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 53.33 110.922 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -52.73 -56.99 11.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 74.32 110.843 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.75 -59.28 4.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 70.33 110.912 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.8 t -53.31 -38.27 63.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 71.31 110.864 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.69 -43.71 98.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 72.14 110.838 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.08 -57.5 8.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 63.45 111.008 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -55.01 -47.3 74.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.256 -0.429 . . . . 75.51 110.84 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.413 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.95 -48.87 74.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.213 -0.449 . . . . 72.25 110.916 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.97 -41.75 64.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 62.54 111.084 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.749 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.4 mt-30 -69.52 -66.35 0.6 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 50.13 110.904 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.479 HG23 ' N ' ' A' ' 58' ' ' LYS . 27.2 m -47.4 -42.52 7.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 74.13 111.074 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.479 ' N ' HG23 ' A' ' 57' ' ' VAL . 3.7 mmtp -64.03 -50.76 67.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 73.22 110.836 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.53 -50.71 52.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 72.22 111.099 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.507 ' CG ' HG21 ' A' ' 27' ' ' THR . 0.3 OUTLIER -67.82 -43.95 78.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.233 -0.439 . . . . 72.14 110.924 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 36.5 mtp85 -51.04 -43.95 61.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 72.02 110.895 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.33 -55.42 8.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 75.13 111.097 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.83 -37.93 53.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 54.3 110.839 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.41 HG12 ' O ' ' A' ' 60' ' ' PHE . 5.2 p -84.86 -22.82 7.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 72.4 111.093 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 74.22 110.9 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.511 HG11 HG23 ' A' ' 74' ' ' ILE . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.858 0.361 . . . . 73.32 111.123 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.602 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -82.27 160.81 61.71 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.55 0.691 . . . . 43.12 111.071 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.602 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.4 Cg_endo -69.75 -7.63 21.55 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.632 2.222 . . . . 72.52 112.413 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -101.16 -36.28 9.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 71.53 110.919 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -56.6 -61.4 2.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 71.33 110.922 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.783 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.33 -68.7 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 74.21 111.089 179.944 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 28.1 m -48.53 -39.23 10.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 71.12 111.143 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.1 mtmt -60.68 -39.59 88.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 74.41 110.872 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.53 HG22 ' HB2' ' A' ' 121' ' ' ASP . 90.2 t -70.14 -36.91 70.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.189 -0.459 . . . . 74.5 111.126 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.3 OUTLIER -69.96 -34.27 73.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.192 -0.458 . . . . 54.24 110.917 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.7 ptpt -88.73 -19.78 25.65 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.181 -0.463 . . . . 74.11 110.861 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.469 ' HG2' HD23 ' A' ' 81' ' ' LEU . 3.1 ttmt -75.85 -50.63 14.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.258 -0.428 . . . . 71.23 110.87 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.824 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.1 mt -91.27 13.14 18.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.274 -0.421 . . . . 64.35 110.932 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 7.5 t 52.22 41.18 30.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 54.04 110.857 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.824 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.6 mm? -79.48 85.0 5.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 70.21 110.913 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.598 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -46.84 155.99 0.23 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 63.52 111.143 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -59.1 -20.62 55.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 75.24 110.902 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.01 -53.57 6.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 73.01 110.922 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.598 ' H ' HG23 ' A' ' 84' ' ' THR . 0.6 OUTLIER -65.9 -53.79 34.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 64.1 110.885 179.953 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.481 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -51.49 -31.87 25.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 73.15 111.046 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 44.4 t -80.24 -39.95 28.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.266 -0.425 . . . . 62.4 110.795 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -71.69 -20.89 61.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.473 . . . . 63.23 110.861 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.711 ' CD1' HD12 ' A' ' 127' ' ' LEU . 53.3 mt -104.31 -64.05 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 61.13 111.098 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.535 ' HB3' HG23 ' A' ' 113' ' ' THR . 8.7 m-85 -74.58 -61.15 1.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 75.43 110.834 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 113.09 47.96 0.63 Allowed Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.7 -0.762 . . . . 44.31 112.494 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.631 ' C ' ' HB2' ' A' ' 98' ' ' ALA . . . -68.04 -38.46 88.48 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.753 -0.737 . . . . 41.52 112.472 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 98.72 -164.94 20.98 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.768 -0.73 . . . . 71.53 112.489 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 5.2 t -71.41 -70.71 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.805 0.336 . . . . 62.22 111.107 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 26.1 t30 -84.87 39.41 0.75 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 71.14 110.847 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.631 ' HB2' ' C ' ' A' ' 94' ' ' GLY . . . -61.54 -71.69 0.14 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 55.14 111.016 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -41.15 -42.74 2.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 75.24 110.872 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.44 -74.72 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.162 -0.472 . . . . 74.31 110.86 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.606 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 10.0 mtt180 -48.27 -49.45 33.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.095 -0.502 . . . . 64.23 110.924 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.536 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.4 m-85 -53.8 -37.23 63.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 64.35 110.901 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -53.36 -34.65 58.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.135 -0.484 . . . . 74.53 110.88 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.61 -19.83 16.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 61.22 110.9 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.08 26.74 11.9 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.775 -0.726 . . . . 73.05 112.444 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -98.82 -6.16 29.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.882 0.372 . . . . 71.23 110.898 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.606 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -117.44 17.58 14.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.479 . . . . 22.02 111.099 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.429 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 0.0 OUTLIER -126.48 55.31 13.54 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.552 0.692 . . . . 71.14 110.944 -179.929 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.497 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.0 Cg_endo -69.8 38.5 0.26 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.667 2.245 . . . . 64.45 112.37 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.732 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.7 t60 71.63 34.9 0.08 OUTLIER Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 121.604 0.716 . . . . 74.34 110.88 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.732 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.1 Cg_endo -69.82 -163.88 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.184 0 C-N-CA 122.714 2.276 . . . . 74.13 112.319 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 83.9 p -86.82 -29.56 22.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 63.14 110.889 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.535 HG23 ' HB3' ' A' ' 92' ' ' PHE . 18.8 m -56.25 -47.19 79.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.09 -0.505 . . . . 73.42 111.114 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.43 HG23 HG21 ' A' ' 69' ' ' VAL . 47.5 mm -56.29 -44.83 80.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 62.53 111.182 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.417 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -66.74 -28.97 68.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.108 -0.496 . . . . 73.22 110.892 179.845 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.52 ' CD2' HD12 ' A' ' 130' ' ' ILE . 5.6 mp -79.36 -42.12 26.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.259 -0.428 . . . . 74.04 110.945 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.783 HD13 HG22 ' A' ' 74' ' ' ILE . 19.3 mt -63.57 -48.84 75.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.241 -0.436 . . . . 65.23 110.917 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.593 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.3 ptp180 -52.61 -35.4 54.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 60.54 110.889 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.593 HG13 ' HG3' ' A' ' 118' ' ' ARG . 28.8 m -93.09 -13.36 8.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 73.22 111.11 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.747 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -78.05 -40.23 39.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 72.21 110.899 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . 0.53 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.6 OUTLIER -49.95 -30.91 11.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.124 -0.489 . . . . 72.41 110.88 179.848 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.7 -20.3 17.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 73.22 110.895 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.747 ' O ' HD13 ' A' ' 120' ' ' LEU . 40.6 m-70 -127.98 87.73 54.89 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.557 0.694 . . . . 61.53 110.826 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.568 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.9 Cg_endo -69.78 3.42 2.79 Favored 'Trans proline' 0 N--CA 1.465 -0.174 0 C-N-CA 122.686 2.258 . . . . 63.34 112.384 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -117.19 -12.75 10.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 74.54 110.859 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.666 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.3 tp -53.95 -46.91 71.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 71.22 110.919 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.711 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.48 -29.64 6.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.476 . . . . 64.0 110.872 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.5 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.42 -28.37 23.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 73.41 110.891 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.423 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -93.29 4.36 54.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.185 -0.461 . . . . 71.44 110.855 179.996 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.666 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.0 pt -123.24 -35.03 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 75.14 111.163 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.5 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.8 ptt-85 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.481 . . . . 65.42 110.89 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 mmt . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.882 0.373 . . . . 71.03 110.874 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.35 -169.64 0.46 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.446 . . . . 75.44 110.92 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 1.7 p 178.78 55.74 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.592 0.71 . . . . 43.34 110.891 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 53.5 Cg_endo -69.77 -8.64 24.12 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.674 2.249 . . . . 71.42 112.346 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.664 HG21 ' CD ' ' A' ' 42' ' ' GLU . 6.8 m -67.49 -49.48 70.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.198 -0.455 . . . . 73.21 111.082 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.455 ' N ' HG23 ' A' ' 5' ' ' VAL . 1.2 m -133.3 -20.98 2.08 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.187 -0.461 . . . . 61.32 110.933 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 66.58 89.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 72.33 110.874 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.637 HE21 ' N ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -132.14 -65.89 0.72 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 75.22 110.94 -179.903 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.524 ' HA3' HG13 ' A' ' 38' ' ' VAL . . . -129.54 -95.4 0.77 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.739 -0.744 . . . . 52.11 112.464 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.586 ' HG2' HG12 ' A' ' 38' ' ' VAL . 7.1 pt-20 -177.67 95.3 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.805 0.336 . . . . 70.42 110.866 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.567 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -62.27 102.65 0.32 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 75.52 110.851 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.9 p -143.88 128.52 14.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 64.13 111.114 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.627 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -48.42 129.63 16.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 73.31 110.861 -179.829 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.404 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 178.05 81.15 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.74 -0.743 . . . . 74.04 112.545 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.408 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -36.8 146.22 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.843 0.354 . . . . 74.44 111.13 -179.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.32 -165.48 1.59 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.138 -0.483 . . . . 73.34 110.912 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.674 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.7 OUTLIER -94.24 118.21 31.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.305 -0.407 . . . . 75.12 110.92 179.85 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.746 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.1 mm -109.87 90.99 10.02 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.593 0.711 . . . . 71.03 111.158 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.455 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.2 Cg_endo -69.84 96.29 0.59 Allowed 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.704 2.269 . . . . 61.1 112.26 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -63.18 -36.44 83.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 63.41 110.964 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.534 HG21 ' HG2' ' A' ' 25' ' ' ARG . 58.8 m -129.33 151.43 49.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.109 -0.496 . . . . 61.12 111.117 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -146.1 40.37 1.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 73.4 110.869 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.461 ' H ' HG22 ' A' ' 21' ' ' THR . 5.7 mtt85 -125.21 -57.37 1.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 71.45 110.856 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -145.52 -39.21 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.803 -0.713 . . . . 64.21 112.501 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.534 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -105.19 40.8 1.45 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.826 0.346 . . . . 74.32 110.863 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.472 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 0.7 OUTLIER -51.03 115.16 1.4 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 73.32 110.9 179.924 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 27' ' ' THR . 1.8 t -128.98 94.87 3.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.254 -0.43 . . . . 73.42 111.154 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.674 HG11 ' HB2' ' A' ' 17' ' ' ASP . 48.3 t -78.3 127.61 38.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 73.31 111.13 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.746 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.3 OUTLIER -84.39 51.68 2.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.124 -0.489 . . . . 62.31 110.852 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 29' ' ' LEU . 35.5 mttp -37.4 107.51 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.256 -0.429 . . . . 71.22 110.871 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.19 48.11 0.4 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.743 -0.741 . . . . 72.21 112.506 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.6 HD11 ' HB3' ' A' ' 29' ' ' LEU . 18.7 mm -108.07 92.38 2.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.842 0.353 . . . . 61.5 111.181 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.8 153.52 38.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 61.35 110.863 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.64 -108.62 0.31 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.774 -0.727 . . . . 52.54 112.459 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.753 HD12 ' HB ' ' A' ' 44' ' ' ILE . 48.8 mt -156.74 86.24 0.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.879 0.371 . . . . 71.4 110.898 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.44 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.83 162.79 32.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 74.14 110.858 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.0 t -164.7 -39.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.082 -0.508 . . . . 73.4 110.924 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.586 HG12 ' HG2' ' A' ' 10' ' ' GLU . 5.5 p -129.86 -44.13 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 53.44 111.123 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.439 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -90.79 169.81 10.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.203 -0.453 . . . . 71.53 110.784 179.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.2 p -134.92 6.92 3.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.485 . . . . 74.13 110.931 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -93.73 -65.3 1.0 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.474 . . . . 54.2 110.904 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.664 ' CD ' HG21 ' A' ' 5' ' ' VAL . 16.1 tp10 -75.95 61.4 1.49 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 65.02 110.902 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.9 p -100.64 158.59 15.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 74.12 110.835 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.753 ' HB ' HD12 ' A' ' 35' ' ' LEU . 20.8 mm -142.81 140.01 27.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.149 -0.478 . . . . 74.12 111.114 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.7 mtt -143.75 133.88 24.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 73.23 110.889 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.3 m-20 -86.19 -169.87 2.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 64.13 110.869 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.87 -59.12 5.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 53.33 110.909 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -53.79 -56.53 16.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 74.32 110.926 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.29 -59.56 4.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.074 -0.512 . . . . 70.33 110.944 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.5 t -54.17 -39.38 66.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.486 . . . . 71.31 110.867 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.8 -45.47 89.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.128 -0.487 . . . . 72.14 110.857 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.81 -58.96 4.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.193 -0.458 . . . . 63.45 111.137 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.464 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.1 t80 -53.99 -47.8 71.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.189 -0.46 . . . . 75.51 110.899 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.408 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.28 -48.77 76.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.131 -0.486 . . . . 72.25 110.901 179.946 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.25 -41.77 63.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 62.54 111.05 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.741 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.7 mt-30 -70.19 -66.62 0.57 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 50.13 110.886 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.464 HG13 ' O ' ' A' ' 53' ' ' PHE . 13.5 m -47.32 -35.3 3.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 74.13 111.164 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.3 mmmt -70.29 -52.35 23.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 73.22 110.888 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.48 -50.77 59.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.251 -0.431 . . . . 72.22 111.138 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.65 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -65.14 -47.63 76.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.438 . . . . 72.14 110.834 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.11 -51.75 40.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.132 -0.485 . . . . 72.02 110.895 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.78 -54.76 34.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 75.13 111.08 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.19 -42.53 40.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 54.3 110.796 -179.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 60' ' ' PHE . 37.5 t -76.56 -27.32 17.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.435 . . . . 72.4 111.143 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 74.22 110.916 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.401 HG21 HD12 ' A' ' 114' ' ' ILE . 17.2 m . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.889 0.376 . . . . 73.32 111.126 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.464 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.3 156.93 36.08 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.589 0.709 . . . . 43.12 111.131 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.48 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.3 Cg_endo -69.83 -7.95 22.38 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.699 2.266 . . . . 72.52 112.314 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.32 -34.68 10.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.446 . . . . 71.53 110.822 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.404 ' CE1' ' HA ' ' A' ' 118' ' ' ARG . 12.9 t80 -58.93 -61.15 2.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 71.33 110.864 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.841 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -43.91 -66.39 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.21 111.145 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.1 m -50.95 -38.64 18.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 71.12 111.068 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt -59.54 -47.8 84.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 74.41 110.912 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.5 t -60.78 -39.54 82.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.152 -0.476 . . . . 74.5 111.094 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.2 OUTLIER -62.14 -58.77 6.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 54.24 110.86 -179.936 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -19.97 65.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 74.11 110.865 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.3 ttmm -69.33 -55.83 9.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 71.23 110.853 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.716 HD13 HD12 ' A' ' 120' ' ' LEU . 7.1 mt -91.39 15.12 12.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.267 -0.424 . . . . 64.35 110.914 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 53.4 39.26 29.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 54.04 110.832 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.701 HD22 ' CE2' ' A' ' 92' ' ' PHE . 0.4 OUTLIER -79.84 87.09 5.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.137 -0.483 . . . . 70.21 110.921 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.598 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.39 156.74 0.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.162 -0.472 . . . . 63.52 111.178 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -58.78 -21.47 55.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 75.24 110.902 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.47 -54.19 6.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 73.01 110.917 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.598 ' H ' HG23 ' A' ' 84' ' ' THR . 0.7 OUTLIER -61.48 -53.15 60.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 64.1 110.921 179.897 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.42 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -51.57 -32.46 28.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.083 -0.508 . . . . 73.15 111.077 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 4.3 m -80.72 -34.44 34.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.296 -0.411 . . . . 62.4 110.856 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -76.26 -21.61 56.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.101 -0.499 . . . . 63.23 110.868 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.742 ' CD1' HD12 ' A' ' 127' ' ' LEU . 40.6 mt -105.65 -62.22 2.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.446 . . . . 61.13 111.113 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.701 ' CE2' HD22 ' A' ' 83' ' ' LEU . 5.4 m-85 -75.69 -63.22 1.35 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 75.43 110.897 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 115.54 48.72 0.5 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.736 -0.745 . . . . 44.31 112.516 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -70.37 -37.06 70.15 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.738 -0.744 . . . . 41.52 112.453 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 103.87 -160.0 16.37 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.743 -0.742 . . . . 71.53 112.464 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.8 t -76.7 -69.93 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.927 0.394 . . . . 62.22 111.14 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -85.37 44.09 1.07 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.467 . . . . 71.14 110.893 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -59.05 -75.58 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 55.14 111.09 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.403 ' C ' ' O ' ' A' ' 98' ' ' ALA . 36.6 m-85 -37.75 -43.26 0.64 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.216 -0.447 . . . . 75.24 110.924 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.2 t -58.31 -75.86 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 74.31 110.859 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.617 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 20.9 mtt180 -49.45 -49.24 46.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 64.23 110.851 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.595 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.4 m-85 -53.0 -36.21 60.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 64.35 110.916 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -52.72 -36.29 57.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 74.53 110.856 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.79 -19.6 16.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 61.22 110.903 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.78 24.46 13.35 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.768 -0.73 . . . . 73.05 112.507 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -95.58 -5.78 41.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.803 0.335 . . . . 71.23 110.876 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.617 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -115.02 17.43 16.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 22.02 111.133 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.566 ' HB2' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -129.49 56.03 21.86 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.603 0.716 . . . . 71.14 110.889 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.514 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.6 Cg_endo -69.75 38.67 0.26 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.734 2.289 . . . . 64.45 112.339 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.745 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER 72.05 34.21 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.547 0.689 . . . . 74.34 110.849 179.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.745 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.1 Cg_endo -69.81 -164.5 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.632 2.222 . . . . 74.13 112.34 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 4.1 p -88.94 -27.15 21.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.138 -0.483 . . . . 63.14 110.932 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.569 HG23 ' HB3' ' A' ' 92' ' ' PHE . 8.3 m -56.94 -49.85 74.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.058 -0.519 . . . . 73.42 111.121 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.566 HD11 ' HB2' ' A' ' 108' ' ' GLN . 36.5 mm -47.5 -45.75 10.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 62.53 111.169 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.708 ' HD3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -65.39 -46.98 77.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.475 . . . . 73.22 110.818 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.708 HD12 ' HD3' ' A' ' 115' ' ' LYS . 7.8 mp -60.16 -34.15 73.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.273 -0.421 . . . . 74.04 111.002 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.841 HD13 HG22 ' A' ' 74' ' ' ILE . 25.4 mt -69.69 -56.79 6.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 65.23 110.907 179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.47 ' HG3' HG13 ' A' ' 119' ' ' VAL . 11.5 ptp180 -51.0 -34.09 27.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.152 -0.476 . . . . 60.54 110.911 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.518 HG23 HD23 ' A' ' 126' ' ' LEU . 18.6 m -87.71 -20.31 7.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.155 -0.475 . . . . 73.22 111.136 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.754 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -75.21 -40.51 59.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.136 -0.484 . . . . 72.21 110.891 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -49.89 -31.42 12.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 72.41 110.825 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -94.99 -21.21 18.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 73.22 110.937 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.754 ' O ' HD13 ' A' ' 120' ' ' LEU . 91.7 m-70 -131.37 91.69 34.3 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.626 0.727 . . . . 61.53 110.846 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.621 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.8 Cg_endo -69.77 0.7 5.28 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.699 2.266 . . . . 63.34 112.316 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -114.45 -13.02 12.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.208 -0.451 . . . . 74.54 110.9 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.518 HD23 HG23 ' A' ' 119' ' ' VAL . 6.3 tp -53.06 -49.28 66.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.143 -0.481 . . . . 71.22 110.913 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.742 HD12 ' CD1' ' A' ' 91' ' ' ILE . 2.6 pt? -46.65 -32.55 3.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 64.0 110.956 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.39 -38.44 26.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 73.41 110.929 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.582 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.7 OUTLIER -78.09 -7.59 57.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 71.44 110.891 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.582 HG23 ' HG3' ' A' ' 129' ' ' GLU . 7.1 pt -118.73 -17.03 7.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.164 -0.471 . . . . 75.14 111.122 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 65.42 110.903 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.81 0.338 . . . . 71.03 110.858 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.495 ' O ' ' HB2' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -174.69 -170.6 0.5 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 75.44 110.864 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 49.6 t 176.11 59.49 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.613 0.72 . . . . 43.34 110.867 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 1.04 4.82 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.638 2.225 . . . . 71.42 112.328 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.469 HG23 ' N ' ' A' ' 6' ' ' CYS . 34.1 m -87.84 -42.63 15.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 73.21 111.136 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.469 ' N ' HG23 ' A' ' 5' ' ' VAL . 1.2 t -126.97 -24.33 3.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 61.32 110.918 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.432 ' N ' ' O ' ' A' ' 3' ' ' CYS . 16.2 m-70 62.92 47.67 4.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 72.33 110.785 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -102.25 -75.26 0.6 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 75.22 110.914 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -110.77 -137.95 7.63 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.694 -0.765 . . . . 52.11 112.56 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -144.54 104.48 4.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.85 0.357 . . . . 70.42 110.877 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.558 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -67.43 107.25 2.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 75.52 110.914 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -146.97 130.89 9.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 64.13 111.121 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.563 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -47.99 132.24 15.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 73.31 110.895 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.41 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 177.18 79.69 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.751 -0.738 . . . . 74.04 112.514 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.41 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.88 146.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.913 0.387 . . . . 74.44 111.095 -179.941 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.09 -165.72 1.67 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 73.34 110.913 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.697 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -94.88 116.73 29.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.241 -0.436 . . . . 75.12 110.91 179.843 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.746 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.0 mm -107.93 90.74 6.81 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.616 0.722 . . . . 71.03 111.138 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.481 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.73 96.12 0.58 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.706 2.271 . . . . 61.1 112.332 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.0 t80 -64.58 -35.96 82.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 63.41 110.84 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.492 HG21 ' HG2' ' A' ' 25' ' ' ARG . 20.2 m -131.35 152.35 50.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.457 . . . . 61.12 111.16 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -155.29 37.64 0.39 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.257 -0.429 . . . . 73.4 110.935 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.38 -34.0 1.86 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.157 -0.474 . . . . 71.45 110.89 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -156.91 -51.0 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.741 -0.742 . . . . 64.21 112.468 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.492 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -107.71 53.14 0.7 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.859 0.361 . . . . 74.32 110.883 -179.859 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.408 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 19.4 tttt -56.73 121.11 9.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.487 . . . . 73.32 110.909 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.414 ' O ' HG23 ' A' ' 27' ' ' THR . 1.8 t -136.8 92.95 2.79 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.288 -0.415 . . . . 73.42 111.144 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.697 HG11 ' HB2' ' A' ' 17' ' ' ASP . 45.8 t -77.3 128.12 38.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 73.31 111.151 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.752 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.67 51.88 2.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.188 -0.46 . . . . 62.31 110.908 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.401 ' C ' ' O ' ' A' ' 29' ' ' LEU . 30.5 mttp -37.25 107.24 0.06 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 71.22 110.903 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.7 50.03 0.37 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.797 -0.716 . . . . 72.21 112.526 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.594 HD11 ' HB3' ' A' ' 29' ' ' LEU . 19.1 mm -109.46 92.65 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.894 0.378 . . . . 61.5 111.18 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.42 154.0 37.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 61.35 110.843 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.64 -108.46 0.31 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.78 -0.724 . . . . 52.54 112.497 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.755 HD12 ' HB ' ' A' ' 44' ' ' ILE . 61.0 mt -156.67 86.16 0.99 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.85 0.357 . . . . 71.4 110.986 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.445 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -161.45 164.3 29.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.15 -0.477 . . . . 74.14 110.923 -179.931 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 9.9 t -169.29 -44.33 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 73.4 110.835 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.0 m -120.69 -47.41 2.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 53.44 111.148 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.88 172.71 8.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 71.53 110.895 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.8 t -138.15 9.86 2.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.425 . . . . 74.13 110.951 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -97.91 -63.31 1.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 54.2 110.929 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -76.66 60.59 1.7 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.14 -0.482 . . . . 65.02 110.933 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.9 p -98.3 158.65 15.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 74.12 110.854 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.755 ' HB ' HD12 ' A' ' 35' ' ' LEU . 18.3 mm -144.31 139.39 24.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 74.12 111.169 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.8 mtt -142.06 137.51 31.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.192 -0.458 . . . . 73.23 110.975 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 40.9 m-20 -89.05 -169.52 2.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 64.13 110.887 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? -54.78 -59.8 4.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 53.33 110.857 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -56.84 13.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 74.32 110.905 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.02 -59.43 4.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.105 -0.498 . . . . 70.33 110.92 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.9 t -53.62 -41.23 66.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.127 -0.488 . . . . 71.31 110.89 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -57.6 -45.23 85.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 72.14 110.876 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.62 -61.04 2.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 63.45 111.084 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.447 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.5 t80 -52.49 -48.37 65.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 75.51 110.92 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.431 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.32 -49.32 76.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 72.25 110.842 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.43 -41.71 61.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 62.54 111.068 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.752 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.6 mt-30 -70.18 -67.38 0.5 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.449 . . . . 50.13 110.89 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.0 m -46.98 -35.74 3.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 74.13 111.142 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -69.52 -54.25 15.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 73.22 110.92 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.25 -51.75 31.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 72.22 111.124 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.661 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -63.66 -49.13 74.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.167 -0.47 . . . . 72.14 110.876 -179.874 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.65 -36.68 36.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.043 -0.526 . . . . 72.02 110.805 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.12 -54.01 9.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.292 -0.413 . . . . 75.13 111.06 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.29 -28.57 65.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 54.3 110.837 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.661 HG22 ' O ' ' A' ' 60' ' ' PHE . 19.9 m -94.14 -17.38 7.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.147 -0.479 . . . . 72.4 111.185 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 74.22 110.935 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 17.0 m . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.812 0.339 . . . . 73.32 111.054 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.403 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -105.92 155.45 38.32 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.52 0.676 . . . . 43.12 111.08 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.471 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.1 Cg_endo -69.68 -6.93 19.74 Favored 'Trans proline' 0 N--CA 1.465 -0.156 0 C-N-CA 122.708 2.272 . . . . 72.52 112.355 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.06 -34.78 9.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 71.53 110.905 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.661 ' O ' HG23 ' A' ' 77' ' ' VAL . 16.4 t80 -58.34 -61.83 2.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 71.33 110.834 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.92 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -39.54 -69.98 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.15 -0.477 . . . . 74.21 111.105 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.41 HG23 ' N ' ' A' ' 76' ' ' LYS . 35.9 m -49.37 -39.81 13.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 71.12 111.136 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.41 ' N ' HG23 ' A' ' 75' ' ' VAL . 7.5 mtmt -61.46 -38.29 86.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.152 -0.476 . . . . 74.41 110.894 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 73' ' ' PHE . 16.6 t -69.81 -38.15 75.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.245 -0.434 . . . . 74.5 111.123 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.2 OUTLIER -69.93 -33.33 72.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.138 -0.483 . . . . 54.24 110.866 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -88.05 -21.83 24.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.149 -0.478 . . . . 74.11 110.924 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.488 ' HG2' HD23 ' A' ' 81' ' ' LEU . 18.7 ttmt -74.16 -50.5 19.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.204 -0.453 . . . . 71.23 110.897 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.799 ' HB2' HD23 ' A' ' 83' ' ' LEU . 12.8 mt -89.71 12.05 18.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.244 -0.434 . . . . 64.35 111.003 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 65.3 m 53.14 39.8 30.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.149 -0.478 . . . . 54.04 110.888 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.799 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.7 mm? -79.56 83.99 5.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.125 -0.489 . . . . 70.21 110.891 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.593 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.43 157.3 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.16 -0.473 . . . . 63.52 111.164 179.913 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -56.29 -23.19 35.07 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.245 -0.434 . . . . 75.24 110.921 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.4 mmtp -80.0 -47.1 15.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 73.01 110.916 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.593 ' H ' HG23 ' A' ' 84' ' ' THR . 8.9 tp10 -67.22 -56.25 10.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.271 -0.422 . . . . 64.1 110.827 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.432 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -50.79 -38.67 49.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 73.15 111.045 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 96.6 p -77.53 -32.3 53.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 62.4 110.86 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -73.72 -28.86 61.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 63.23 110.925 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.774 HD12 ' HB3' ' A' ' 131' ' ' ARG . 11.4 mm -99.92 -63.59 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 61.13 111.192 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.647 ' HB3' HG23 ' A' ' 113' ' ' THR . 8.9 m-85 -70.08 -61.57 1.73 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.128 -0.487 . . . . 75.43 110.863 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 111.95 41.66 1.07 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.755 -0.736 . . . . 44.31 112.458 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -57.83 -44.95 94.07 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.698 -0.763 . . . . 41.52 112.495 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.69 -151.2 16.95 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.799 -0.715 . . . . 71.53 112.505 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.0 t -85.41 -69.1 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.822 0.344 . . . . 62.22 111.104 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -83.33 39.58 0.67 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 71.14 110.876 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.21 -79.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.119 -0.491 . . . . 55.14 111.112 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -37.68 -43.07 0.61 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.343 -0.39 . . . . 75.24 110.874 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.0 -76.45 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 74.31 110.833 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.55 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 55.7 mtt180 -50.09 -49.46 51.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 64.23 110.897 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.486 ' HB3' HD12 ' A' ' 74' ' ' ILE . 8.9 m-85 -51.17 -37.35 45.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.241 -0.436 . . . . 64.35 110.88 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -51.22 -38.33 51.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 74.53 110.871 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.95 -18.56 17.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.105 -0.498 . . . . 61.22 110.902 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.94 26.32 11.71 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.723 -0.751 . . . . 73.05 112.539 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -96.37 -4.18 42.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.892 0.377 . . . . 71.23 110.911 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.55 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -120.69 18.4 11.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 22.02 111.093 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.444 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -126.28 55.91 14.9 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.661 0.743 . . . . 71.14 110.932 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.494 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.4 Cg_endo -69.74 36.51 0.23 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.698 2.266 . . . . 64.45 112.327 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.743 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 4.7 t-160 71.67 34.27 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.576 0.703 . . . . 74.34 110.881 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.743 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.3 Cg_endo -69.79 -164.26 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.648 2.232 . . . . 74.13 112.33 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 28.3 t -83.64 -30.82 26.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.145 -0.48 . . . . 63.14 110.876 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.68 HG22 ' CD1' ' A' ' 117' ' ' LEU . 54.1 m -54.94 -50.68 68.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.108 -0.496 . . . . 73.42 111.102 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.405 ' HA ' HD12 ' A' ' 117' ' ' LEU . 44.0 mm -54.21 -47.75 67.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 62.53 111.13 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -28.59 70.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.462 . . . . 73.22 110.968 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.523 ' O ' HD23 ' A' ' 120' ' ' LEU . 5.1 mp -79.59 -42.01 25.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 74.04 110.932 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.92 HD13 HG22 ' A' ' 74' ' ' ILE . 4.4 mt -61.48 -48.55 80.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 65.23 110.917 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.527 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.9 ptp180 -54.06 -35.32 61.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 60.54 110.867 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.584 HG23 HD23 ' A' ' 126' ' ' LEU . 34.5 m -92.97 -10.65 9.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 73.22 111.159 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.747 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.7 OUTLIER -83.42 -39.98 19.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 72.21 110.898 179.971 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -50.33 -31.68 15.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 72.41 110.859 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.16 -19.66 19.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 73.22 110.938 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.747 ' O ' HD13 ' A' ' 120' ' ' LEU . 88.2 m-70 -130.82 90.39 40.13 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.558 0.694 . . . . 61.53 110.876 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.558 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.4 Cg_endo -69.73 0.39 5.69 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.664 2.243 . . . . 63.34 112.289 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -113.93 -11.91 12.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.248 -0.433 . . . . 74.54 110.874 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.694 ' O ' HG23 ' A' ' 130' ' ' ILE . 6.7 tp -53.95 -47.87 70.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 71.22 110.892 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.772 HD13 HD11 ' A' ' 83' ' ' LEU . 2.0 pt? -51.0 -28.76 10.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 64.0 110.985 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.481 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.68 -27.21 23.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 73.41 110.892 179.9 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.403 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.1 pp20? -94.31 2.48 55.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.475 . . . . 71.44 110.839 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.694 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.5 pt -121.12 -33.99 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 75.14 111.174 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.774 ' HB3' HD12 ' A' ' 91' ' ' ILE . 2.3 ptt-85 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 65.42 110.911 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.579 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 4.6 mmt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.877 0.37 . . . . 71.03 110.916 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.77 -169.35 0.41 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 75.44 110.902 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 t -179.44 58.6 0.1 Allowed Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.572 0.701 . . . . 43.34 110.861 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 3.15 2.95 Favored 'Trans proline' 0 N--CA 1.465 -0.2 0 C-N-CA 122.72 2.28 . . . . 71.42 112.389 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.6 m -107.58 -45.71 7.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.199 -0.455 . . . . 73.21 111.077 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -106.92 -33.47 7.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 61.32 110.947 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.6 m-70 59.48 24.85 13.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.14 -0.482 . . . . 72.33 110.827 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -92.14 -67.22 0.87 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 75.22 110.991 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.74 -135.32 6.36 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.729 -0.748 . . . . 52.11 112.477 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.579 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 9.5 pt-20 -145.62 95.23 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.841 0.353 . . . . 70.42 110.913 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.537 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.5 OUTLIER -59.67 104.91 0.32 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.221 -0.445 . . . . 75.52 110.889 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 8.8 p -145.9 133.04 14.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.43 . . . . 64.13 111.145 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.537 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -49.25 132.75 19.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.178 -0.464 . . . . 73.31 110.868 -179.848 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.426 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 178.09 77.58 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.752 -0.737 . . . . 74.04 112.483 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.426 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -35.65 143.8 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.91 0.386 . . . . 74.44 111.094 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.31 -168.15 2.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.132 -0.485 . . . . 73.34 110.912 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -93.27 116.08 28.66 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.22 -0.445 . . . . 75.12 110.88 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.783 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.6 mm -107.68 91.35 7.24 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.654 0.74 . . . . 71.03 111.098 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.495 ' HB3' HG12 ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.8 105.1 1.43 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.716 2.277 . . . . 61.1 112.306 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -70.69 -29.64 66.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.993 0.425 . . . . 63.41 110.932 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.57 HG21 ' HG2' ' A' ' 25' ' ' ARG . 24.3 m -130.74 146.36 52.19 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.114 -0.493 . . . . 61.12 111.231 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -140.17 48.23 1.78 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 73.4 110.908 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.16 -69.03 0.57 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 71.45 110.847 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -134.56 -40.45 0.17 Allowed Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.746 -0.74 . . . . 64.21 112.428 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.57 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -102.95 39.61 1.52 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.901 0.381 . . . . 74.32 110.897 -179.84 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.414 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 11.1 tttt -49.33 109.65 0.29 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 73.32 110.86 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.597 HG21 ' CD1' ' A' ' 60' ' ' PHE . 2.2 t -128.08 92.27 3.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.275 -0.42 . . . . 73.42 111.127 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.495 HG12 ' HB3' ' A' ' 19' ' ' PRO . 0.8 OUTLIER -80.33 140.12 17.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 73.31 111.15 179.865 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.783 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -86.53 63.34 7.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 62.31 110.955 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.9 mttp -41.46 105.56 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 71.22 110.858 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.531 ' O ' HD13 ' A' ' 32' ' ' ILE . . . 115.5 62.1 0.37 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.653 -0.784 . . . . 72.21 112.398 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.598 HD11 ' CB ' ' A' ' 29' ' ' LEU . 19.4 mm -118.31 92.3 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.852 0.358 . . . . 61.5 111.151 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.12 153.25 39.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 61.35 110.827 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 168.22 -109.63 0.35 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.751 -0.738 . . . . 52.54 112.497 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.755 HD12 ' HB ' ' A' ' 44' ' ' ILE . 61.4 mt -156.82 85.81 0.97 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.89 0.376 . . . . 71.4 110.892 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.418 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -158.75 163.35 36.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.161 -0.472 . . . . 74.14 110.895 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -168.38 -47.27 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.068 -0.515 . . . . 73.4 110.93 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.404 HG22 ' HG2' ' A' ' 10' ' ' GLU . 4.2 m -120.54 -47.05 2.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 53.44 111.186 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -87.45 169.42 12.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.167 -0.469 . . . . 71.53 110.849 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.4 m -136.84 15.15 3.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 74.13 110.892 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -103.79 -62.88 1.25 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.157 -0.474 . . . . 54.2 110.925 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.447 ' HG3' ' HE3' ' A' ' 11' ' ' MET . 7.7 tp10 -77.14 61.91 2.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 65.02 110.891 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.3 p -98.03 155.64 17.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.491 . . . . 74.12 110.923 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.755 ' HB ' HD12 ' A' ' 35' ' ' LEU . 21.0 mm -141.84 140.45 30.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.466 . . . . 74.12 111.135 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.8 mtt -144.53 134.79 24.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 73.23 110.884 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.3 m-20 -81.93 -169.85 2.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 64.13 110.851 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.06 -60.1 4.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 53.33 110.934 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -51.76 -57.44 9.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.275 -0.42 . . . . 74.32 110.899 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.42 -58.75 5.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 70.33 110.912 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.9 t -53.74 -38.88 64.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 71.31 110.821 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.75 -43.99 97.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.096 -0.502 . . . . 72.14 110.904 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.83 -58.34 6.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 63.45 111.069 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -54.42 -47.3 72.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.257 -0.429 . . . . 75.51 110.869 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.82 -50.44 68.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.131 -0.486 . . . . 72.25 110.857 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.5 -41.2 60.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 62.54 111.107 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.741 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.4 mt-30 -69.97 -66.99 0.52 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 50.13 110.946 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.43 HG12 HD21 ' A' ' 29' ' ' LEU . 18.1 m -47.82 -35.51 4.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 74.13 111.092 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -69.05 -54.43 15.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 73.22 110.87 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.62 -52.44 39.48 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 72.22 111.134 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.622 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -64.48 -44.69 90.23 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.449 . . . . 72.14 110.893 -179.975 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.0 mtt-85 -50.7 -51.63 47.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.158 -0.473 . . . . 72.02 110.933 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.69 -54.14 36.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 75.13 111.044 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.62 -38.58 32.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 54.3 110.878 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.622 HG23 ' O ' ' A' ' 60' ' ' PHE . 44.4 t -82.4 -25.99 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 72.4 111.121 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.159 -0.473 . . . . 74.22 110.867 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 17.6 m . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.828 0.347 . . . . 73.32 111.136 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -103.14 153.73 38.15 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.541 0.686 . . . . 43.12 111.021 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.528 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.2 Cg_endo -69.67 -7.69 21.68 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.685 2.257 . . . . 72.52 112.367 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -98.85 -36.31 9.83 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.201 -0.454 . . . . 71.53 110.852 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.564 ' O ' HG23 ' A' ' 77' ' ' VAL . 19.8 t80 -57.76 -61.13 2.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.194 -0.457 . . . . 71.33 110.896 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.77 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -40.01 -70.47 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 74.21 111.17 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.7 m -48.85 -38.87 10.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.151 -0.477 . . . . 71.12 111.205 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.6 mtmt -62.77 -39.05 92.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 74.41 110.802 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 73' ' ' PHE . 39.3 t -68.07 -38.07 79.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.268 -0.424 . . . . 74.5 111.121 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.423 ' HG3' ' O ' ' A' ' 74' ' ' ILE . 0.7 OUTLIER -70.33 -36.51 74.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 54.24 110.851 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -84.08 -20.84 31.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.169 -0.469 . . . . 74.11 110.895 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.462 ' HG2' HD23 ' A' ' 81' ' ' LEU . 5.5 ttmt -75.59 -50.19 16.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 71.23 110.87 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.816 ' HB2' HD23 ' A' ' 83' ' ' LEU . 12.9 mt -90.19 12.22 18.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 64.35 110.918 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.3 t 52.47 40.8 30.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 54.04 110.851 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.816 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.6 mm? -79.13 84.61 5.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 70.21 110.864 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.595 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.29 156.33 0.11 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 63.52 111.131 179.943 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -58.33 -24.7 60.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 75.24 110.9 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -77.08 -49.01 16.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 73.01 110.945 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.595 ' H ' HG23 ' A' ' 84' ' ' THR . 0.8 OUTLIER -68.98 -54.83 13.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.226 -0.443 . . . . 64.1 110.919 179.903 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.572 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -51.69 -35.35 42.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 73.15 111.104 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.2 m -78.67 -37.07 42.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 62.4 110.892 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -72.76 -24.79 61.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.128 -0.487 . . . . 63.23 110.82 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.717 ' CD1' HD12 ' A' ' 127' ' ' LEU . 51.9 mt -101.47 -64.09 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 61.13 111.112 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.54 ' HB3' HG23 ' A' ' 113' ' ' THR . 8.0 m-85 -71.72 -61.26 1.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 75.43 110.975 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.65 45.01 1.0 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.796 -0.716 . . . . 44.31 112.458 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -66.59 -46.62 74.9 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.751 -0.738 . . . . 41.52 112.564 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.49 172.54 21.45 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.717 -0.754 . . . . 71.53 112.5 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.675 HG13 ' H ' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -50.9 -66.64 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.869 0.366 . . . . 62.22 111.099 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.675 ' H ' HG13 ' A' ' 96' ' ' VAL . 9.0 t30 -86.24 42.23 0.98 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.155 -0.475 . . . . 71.14 110.882 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.13 -76.18 0.06 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 55.14 111.145 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -39.66 -40.32 0.89 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 75.24 110.866 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.9 m -59.93 -76.28 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.163 -0.471 . . . . 74.31 110.89 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.604 ' HB3' ' HB2' ' A' ' 107' ' ' ALA . 24.6 mtt85 -49.93 -45.66 51.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.102 -0.499 . . . . 64.23 110.885 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.491 ' HB3' HD12 ' A' ' 74' ' ' ILE . 10.4 m-85 -56.96 -36.57 70.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 64.35 110.943 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 -59.81 -25.98 65.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.104 -0.498 . . . . 74.53 110.891 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.11 -20.5 14.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 61.22 110.903 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.15 28.38 11.9 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.742 -0.742 . . . . 73.05 112.564 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 60.1 m-20 -104.35 -8.65 19.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.819 0.342 . . . . 71.23 110.926 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.604 ' HB2' ' HB3' ' A' ' 101' ' ' ARG . . . -114.52 15.14 17.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 22.02 111.12 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.443 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 0.0 OUTLIER -127.04 54.6 12.63 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.529 0.68 . . . . 71.14 110.904 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.502 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.0 Cg_endo -69.75 37.03 0.24 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.642 2.228 . . . . 64.45 112.347 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.748 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.5 t-160 71.9 34.06 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.65 0.738 . . . . 74.34 110.856 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.748 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.4 Cg_endo -69.77 -164.07 0.12 Allowed 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.665 2.243 . . . . 74.13 112.412 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.94 -32.77 30.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.311 -0.404 . . . . 63.14 110.874 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.54 HG23 ' HB3' ' A' ' 92' ' ' PHE . 21.0 m -52.3 -55.35 21.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.476 . . . . 73.42 111.176 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 42.7 mm -50.94 -46.55 30.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 62.53 111.116 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.442 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -62.52 -28.53 69.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 73.22 110.894 179.853 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.442 HD12 ' HG3' ' A' ' 115' ' ' LYS . 5.8 mp -81.29 -47.5 13.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.265 -0.425 . . . . 74.04 110.922 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.77 HD13 HG22 ' A' ' 74' ' ' ILE . 21.5 mt -55.91 -47.75 76.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.47 . . . . 65.23 110.995 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.614 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.0 ptp180 -54.91 -35.6 64.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 60.54 110.915 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.614 HG13 ' HG3' ' A' ' 118' ' ' ARG . 31.7 m -95.7 -3.46 10.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 73.22 111.145 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.747 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -89.68 -40.73 12.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 72.21 110.909 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -49.31 -32.43 11.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.256 -0.429 . . . . 72.41 110.849 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.47 -20.53 18.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 73.22 110.856 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.747 ' O ' HD13 ' A' ' 120' ' ' LEU . 48.0 m-70 -127.36 87.34 56.53 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.602 0.715 . . . . 61.53 110.865 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.602 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.6 Cg_endo -69.73 3.9 2.49 Favored 'Trans proline' 0 C--N 1.341 0.14 0 C-N-CA 122.747 2.298 . . . . 63.34 112.338 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -117.91 -12.42 10.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 74.54 110.897 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.557 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.7 tp -53.6 -48.09 69.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 71.22 110.958 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.717 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.8 pt? -46.33 -32.75 3.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 64.0 110.922 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -81.96 -38.08 25.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 73.41 110.927 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.551 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -78.72 -5.72 53.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.479 . . . . 71.44 110.892 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.557 HG23 ' O ' ' A' ' 126' ' ' LEU . 8.7 pt -118.14 -22.26 4.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.152 -0.476 . . . . 75.14 111.133 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.193 -0.458 . . . . 65.42 110.889 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mtt . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.838 0.352 . . . . 71.03 110.879 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.24 -171.21 0.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.192 -0.458 . . . . 75.44 110.906 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.403 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 0.5 OUTLIER 175.79 56.72 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.651 0.739 . . . . 43.34 110.96 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 53.3 Cg_endo -69.73 2.39 3.56 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.724 2.282 . . . . 71.42 112.327 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.596 HG23 ' HG3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -99.89 -44.6 11.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.448 . . . . 73.21 111.144 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 7' ' ' HIS . 0.1 OUTLIER -112.2 -40.01 4.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.169 -0.469 . . . . 61.32 110.894 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 24.6 m-70 69.29 51.63 0.5 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 72.33 110.854 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -120.31 -71.95 0.71 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 75.22 110.949 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -99.61 -121.38 4.6 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.669 -0.776 . . . . 52.11 112.556 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.504 ' O ' HG12 ' A' ' 12' ' ' VAL . 12.8 pt-20 -169.29 87.52 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.804 0.335 . . . . 70.42 110.938 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.522 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -46.04 105.71 0.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 75.52 110.869 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.504 HG12 ' O ' ' A' ' 10' ' ' GLU . 4.9 p -144.57 129.2 13.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 64.13 111.148 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.494 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.6 p -47.5 126.23 9.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 73.31 110.89 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.88 80.99 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.692 -0.766 . . . . 74.04 112.429 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.409 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.27 147.24 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.88 0.371 . . . . 74.44 111.097 -179.955 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.32 -165.32 1.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 73.34 110.899 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.656 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -96.54 117.34 30.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.262 -0.426 . . . . 75.12 110.851 179.914 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.724 ' O ' HD22 ' A' ' 29' ' ' LEU . 10.7 mm -108.05 91.3 7.68 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.639 0.733 . . . . 71.03 111.146 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.402 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.1 Cg_endo -69.7 96.26 0.58 Allowed 'Trans proline' 0 N--CA 1.464 -0.217 0 C-N-CA 122.754 2.302 . . . . 61.1 112.38 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.499 ' HB3' HG23 ' A' ' 27' ' ' THR . 14.2 t80 -64.29 -34.61 78.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 63.41 110.926 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.586 HG21 ' HG2' ' A' ' 25' ' ' ARG . 17.5 m -130.29 146.89 51.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 61.12 111.155 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -144.63 43.49 1.37 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 73.4 110.917 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.408 ' CD ' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -131.28 -39.64 1.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 71.45 110.802 -179.869 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -160.48 -53.23 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.736 -0.745 . . . . 64.21 112.495 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.586 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.75 42.44 1.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.867 0.365 . . . . 74.32 110.925 -179.897 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.402 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 15.1 tttm -49.77 117.47 2.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 73.32 110.893 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.499 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -128.91 91.04 3.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 73.42 111.08 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.656 HG11 ' HB2' ' A' ' 17' ' ' ASP . 43.0 t -76.62 126.7 37.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.232 -0.44 . . . . 73.31 111.132 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.73 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.77 51.78 2.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 62.31 110.913 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -38.59 107.47 0.07 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 71.22 110.922 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.24 46.09 0.38 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.755 -0.736 . . . . 72.21 112.5 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.566 HD11 ' HB3' ' A' ' 29' ' ' LEU . 13.4 mm -107.37 89.98 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.923 0.392 . . . . 61.5 111.146 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.33 156.43 38.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 61.35 110.875 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.13 -107.39 0.28 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.721 -0.752 . . . . 52.54 112.456 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.732 HD12 ' HB ' ' A' ' 44' ' ' ILE . 55.6 mt -156.27 82.47 0.99 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.896 0.379 . . . . 71.4 110.87 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.469 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -164.88 166.23 19.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.46 . . . . 74.14 110.91 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.5 -34.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 73.4 110.85 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.3 m -121.34 -45.28 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 53.44 111.087 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -98.94 176.02 5.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 71.53 110.856 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.5 p -141.25 28.81 1.84 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.205 -0.452 . . . . 74.13 110.85 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -110.49 -65.68 1.14 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.173 -0.467 . . . . 54.2 110.922 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.596 ' HG3' HG23 ' A' ' 5' ' ' VAL . 27.4 mm-40 -76.56 62.29 1.9 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 65.02 110.937 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.1 p -93.05 138.62 31.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 74.12 110.874 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.732 ' HB ' HD12 ' A' ' 35' ' ' LEU . 13.3 mm -135.71 138.91 47.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.086 -0.507 . . . . 74.12 111.115 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 15.2 mtt -139.3 143.19 37.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 73.23 110.854 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.6 m-20 -90.82 -168.91 2.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 64.13 110.844 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.17 -60.41 3.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.131 -0.486 . . . . 53.33 110.996 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.92 -58.24 7.61 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.139 -0.482 . . . . 74.32 110.9 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -50.5 -59.35 4.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 70.33 110.915 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.0 t -52.45 -42.91 64.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 71.31 110.78 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -57.38 -43.38 83.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.152 -0.476 . . . . 72.14 110.842 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.45 -61.93 1.82 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 63.45 111.113 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.477 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.7 t80 -52.56 -45.84 66.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.179 -0.464 . . . . 75.51 110.887 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.434 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -64.2 -50.41 68.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 72.25 110.842 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.21 -41.73 60.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.303 -0.408 . . . . 62.54 111.153 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.73 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.5 mt-30 -70.64 -66.99 0.53 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 50.13 110.93 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.477 HG13 ' O ' ' A' ' 53' ' ' PHE . 16.3 m -47.03 -35.64 3.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.257 -0.429 . . . . 74.13 111.094 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 11.0 mmmm -70.31 -51.91 26.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 73.22 110.939 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.4 -52.32 46.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.47 . . . . 72.22 111.14 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.644 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -65.29 -46.24 81.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 72.14 110.883 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -49.88 -52.49 32.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.104 -0.498 . . . . 72.02 110.866 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.82 -54.54 33.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 75.13 111.094 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.69 -42.05 33.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 54.3 110.836 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 60' ' ' PHE . 42.9 t -77.15 -28.49 16.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.164 -0.471 . . . . 72.4 111.142 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 74.22 110.853 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 17.0 m . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.912 0.387 . . . . 73.32 111.049 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.5 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -104.92 158.17 32.61 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.547 0.689 . . . . 43.12 111.075 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.5 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.8 Cg_endo -69.79 -8.15 22.88 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.604 2.202 . . . . 72.52 112.42 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -97.81 -34.87 10.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 71.53 110.797 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -57.5 -61.12 2.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.454 . . . . 71.33 110.9 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.867 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.82 -68.04 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 74.21 111.104 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -48.66 -38.88 10.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 71.12 111.177 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.8 mtmt -61.14 -45.5 94.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.456 . . . . 74.41 110.935 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.534 HG22 ' HB2' ' A' ' 121' ' ' ASP . 78.5 t -62.03 -39.48 83.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 74.5 111.112 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.465 HH22 HG21 ' A' ' 113' ' ' THR . 0.2 OUTLIER -63.64 -58.65 6.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 54.24 110.854 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -24.1 67.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 74.11 110.979 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.2 ttmt -67.97 -53.67 24.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 71.23 110.879 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.807 ' HB2' HD23 ' A' ' 83' ' ' LEU . 10.9 mt -90.68 12.79 17.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.192 -0.458 . . . . 64.35 110.947 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.3 t 53.5 38.41 28.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.117 -0.492 . . . . 54.04 110.915 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.807 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.8 mm? -79.58 87.04 5.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.127 -0.488 . . . . 70.21 110.943 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.637 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.55 157.4 0.1 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 63.52 111.115 179.976 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -57.55 -21.49 38.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 75.24 110.921 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -81.16 -49.21 11.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 73.01 110.957 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.637 ' H ' HG23 ' A' ' 84' ' ' THR . 21.9 tp10 -62.47 -54.31 42.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.448 . . . . 64.1 110.863 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.41 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -54.72 -35.8 64.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.483 . . . . 73.15 111.083 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 91.5 p -79.68 -26.11 41.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 62.4 110.832 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.93 -25.88 34.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.469 . . . . 63.23 110.873 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.734 HD12 ' HB3' ' A' ' 131' ' ' ARG . 24.5 mm -103.35 -59.05 3.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.157 -0.474 . . . . 61.13 111.17 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.581 ' HB3' HG23 ' A' ' 113' ' ' THR . 5.8 m-85 -75.77 -60.96 2.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 75.43 110.87 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.3 49.44 0.76 Allowed Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.711 -0.756 . . . . 44.31 112.527 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.79 -37.39 34.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 41.52 112.509 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . 0.418 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 102.11 165.71 26.8 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.685 -0.769 . . . . 71.53 112.467 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.493 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.9 p -51.4 -50.67 27.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.832 0.348 . . . . 62.22 111.15 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.493 ' N ' HG13 ' A' ' 96' ' ' VAL . 14.2 p30 -86.93 37.73 0.77 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 71.14 110.928 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.418 ' HB2' ' O ' ' A' ' 95' ' ' GLY . . . -64.46 -76.43 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 55.14 111.11 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -43.25 -39.97 3.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 75.24 110.893 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.37 -75.38 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 74.31 110.876 -179.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.619 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 44.6 mtt180 -49.92 -45.02 50.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.075 -0.512 . . . . 64.23 110.892 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.723 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.0 m-85 -56.35 -37.54 70.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 64.35 110.909 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -53.35 -27.43 23.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.075 -0.511 . . . . 74.53 110.892 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.56 -22.2 12.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 61.22 110.9 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.23 28.16 9.43 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.77 -0.729 . . . . 73.05 112.48 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 65.3 m-20 -100.36 -6.87 25.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.362 . . . . 71.23 110.915 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.619 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -109.74 10.68 24.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.189 -0.46 . . . . 22.02 111.101 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.45 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -125.61 56.96 16.11 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.585 0.707 . . . . 71.14 110.96 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.532 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.8 Cg_endo -69.75 36.38 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.698 2.265 . . . . 64.45 112.317 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.773 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.6 t60 73.89 32.33 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.646 0.736 . . . . 74.34 110.865 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.773 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 52.9 Cg_endo -69.8 -163.98 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.721 2.281 . . . . 74.13 112.301 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.0 p -86.94 -28.95 22.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.235 -0.439 . . . . 63.14 110.87 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.583 HG22 HD12 ' A' ' 117' ' ' LEU . 22.0 m -53.5 -51.38 62.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.162 -0.472 . . . . 73.42 111.17 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.418 HD11 ' HB2' ' A' ' 108' ' ' GLN . 38.9 mm -51.26 -42.52 26.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 62.53 111.105 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.537 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -67.44 -29.92 69.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.154 -0.475 . . . . 73.22 110.915 179.815 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.537 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.7 mp -79.23 -41.72 27.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.456 . . . . 74.04 110.922 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.867 HD13 HG22 ' A' ' 74' ' ' ILE . 13.8 mt -63.66 -49.51 72.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 65.23 110.902 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.58 ' HG3' HG13 ' A' ' 119' ' ' VAL . 14.5 ptp180 -52.07 -35.7 48.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 60.54 110.882 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.58 HG13 ' HG3' ' A' ' 118' ' ' ARG . 31.0 m -92.57 -14.07 8.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 73.22 111.099 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.768 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -77.04 -39.64 49.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.268 -0.424 . . . . 72.21 110.874 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . 0.534 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.8 OUTLIER -50.44 -31.44 15.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.174 -0.466 . . . . 72.41 110.871 179.873 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -95.8 -19.86 19.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 73.22 110.966 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.768 ' O ' HD13 ' A' ' 120' ' ' LEU . 81.7 m-70 -131.41 90.07 38.92 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.589 0.709 . . . . 61.53 110.801 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.723 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.0 Cg_endo -69.71 0.13 6.05 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.745 2.297 . . . . 63.34 112.324 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -113.8 -11.95 12.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 74.54 110.882 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.68 ' O ' HG23 ' A' ' 130' ' ' ILE . 6.3 tp -53.6 -47.84 69.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.118 -0.492 . . . . 71.22 110.96 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.748 HD13 HD11 ' A' ' 83' ' ' LEU . 2.2 pt? -51.1 -29.0 11.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.12 -0.491 . . . . 64.0 110.968 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.487 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.67 -26.07 24.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.174 -0.466 . . . . 73.41 110.906 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.413 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.0 OUTLIER -95.88 3.31 53.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 71.44 110.917 179.943 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.68 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.8 pt -122.25 -34.52 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 75.14 111.093 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.734 ' HB3' HD12 ' A' ' 91' ' ' ILE . 1.3 ptt-85 . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 65.42 110.84 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mtt . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.884 0.374 . . . . 71.03 110.835 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.63 -169.53 0.43 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.429 . . . . 75.44 110.891 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.5 p 176.88 57.17 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.623 0.725 . . . . 43.34 110.875 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.79 0.52 5.55 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.715 2.277 . . . . 71.42 112.302 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 2.9 m -91.99 -40.37 12.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 73.21 111.2 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 7' ' ' HIS . 0.0 OUTLIER -122.9 -36.33 2.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 61.32 110.858 179.981 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 24.0 m-70 70.49 61.84 0.21 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 72.33 110.844 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -127.8 -77.15 0.57 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 75.22 110.96 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.402 ' HA3' ' HB3' ' A' ' 39' ' ' HIS . . . -94.43 -118.02 2.98 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.785 -0.722 . . . . 52.11 112.478 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.585 ' O ' HG12 ' A' ' 12' ' ' VAL . 8.2 pt-20 -177.45 96.57 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.905 0.383 . . . . 70.42 110.935 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.462 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -48.36 103.74 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 75.52 110.89 -179.974 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.585 HG12 ' O ' ' A' ' 10' ' ' GLU . 3.1 p -141.71 125.11 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 64.13 111.117 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.508 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.2 p -46.66 128.55 10.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.256 -0.429 . . . . 73.31 110.909 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.423 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . -179.7 79.94 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.722 -0.751 . . . . 74.04 112.47 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.423 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.42 146.16 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.905 0.383 . . . . 74.44 111.151 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.8 -166.3 1.96 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 73.34 110.906 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.636 ' HB2' HG11 ' A' ' 28' ' ' VAL . 1.4 p30 -94.63 119.73 33.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 75.12 110.825 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.712 ' O ' HD22 ' A' ' 29' ' ' LEU . 10.3 mm -110.78 92.15 13.97 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.596 0.713 . . . . 71.03 111.181 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.416 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.67 94.87 0.53 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.696 2.264 . . . . 61.1 112.369 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -60.75 -39.02 87.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 63.41 110.961 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.416 HG21 ' HG2' ' A' ' 25' ' ' ARG . 11.3 m -130.67 145.12 51.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.072 -0.513 . . . . 61.12 111.153 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 16.4 p90 -136.12 47.49 2.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.231 -0.44 . . . . 73.4 110.938 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.51 -68.58 0.57 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 71.45 110.89 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.07 -44.88 0.1 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.746 -0.74 . . . . 64.21 112.494 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.416 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -97.79 40.37 1.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.907 0.384 . . . . 74.32 110.92 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -53.92 124.22 14.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 73.32 110.9 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.403 ' O ' HG23 ' A' ' 27' ' ' THR . 1.7 t -139.2 94.46 2.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.142 -0.481 . . . . 73.42 111.131 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.636 HG11 ' HB2' ' A' ' 17' ' ' ASP . 45.1 t -76.8 127.4 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 73.31 111.151 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.764 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.86 51.57 2.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.172 -0.467 . . . . 62.31 110.916 179.956 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 29' ' ' LEU . 22.0 mttp -38.46 107.22 0.06 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 71.22 110.888 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.52 45.51 0.39 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.767 -0.73 . . . . 72.21 112.487 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.558 HD11 ' HB3' ' A' ' 29' ' ' LEU . 15.2 mm -106.3 91.38 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.854 0.359 . . . . 61.5 111.097 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.0 156.87 37.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 61.35 110.827 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.22 -106.89 0.28 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.79 -0.719 . . . . 52.54 112.518 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.753 HD12 ' HB ' ' A' ' 44' ' ' ILE . 50.3 mt -156.17 83.35 1.0 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.88 0.372 . . . . 71.4 110.845 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.534 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -167.97 161.69 12.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.489 . . . . 74.14 110.909 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.35 -33.61 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.161 -0.472 . . . . 73.4 110.886 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.402 HG11 ' HG2' ' A' ' 10' ' ' GLU . 4.5 p -118.93 -24.7 3.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 53.44 111.128 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.402 ' HB3' ' HA3' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -126.17 177.96 6.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.166 -0.47 . . . . 71.53 110.809 179.978 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.8 p -138.92 9.95 2.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 74.13 110.885 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -92.98 -66.04 0.95 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 54.2 110.901 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -75.71 60.92 1.33 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.49 . . . . 65.02 110.87 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.9 p -94.19 149.54 21.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.15 -0.477 . . . . 74.12 110.88 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.753 ' HB ' HD12 ' A' ' 35' ' ' LEU . 16.5 mm -144.1 137.95 24.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.481 . . . . 74.12 111.156 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.7 mtt -139.65 143.58 37.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.246 -0.434 . . . . 73.23 110.863 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -97.14 -168.55 1.72 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 64.13 110.853 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.48 -56.32 19.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.116 -0.493 . . . . 53.33 110.926 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -57.0 -58.3 8.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 74.32 110.928 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.68 -60.29 3.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.133 -0.485 . . . . 70.33 110.891 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.2 t -53.37 -39.41 64.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 71.31 110.856 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.69 -45.83 88.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.088 -0.505 . . . . 72.14 110.863 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.86 -59.16 4.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 63.45 111.089 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.455 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.1 t80 -53.3 -48.23 68.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.17 -0.468 . . . . 75.51 110.858 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.421 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.24 -48.72 77.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 72.25 110.914 179.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.5 -40.49 62.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 62.54 111.072 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.764 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.7 mt-30 -71.09 -66.63 0.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.147 -0.478 . . . . 50.13 110.884 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.2 m -47.6 -35.16 4.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.171 -0.468 . . . . 74.13 111.096 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -71.19 -52.04 21.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 73.22 110.918 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.47 -49.0 62.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.449 . . . . 72.22 111.129 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.618 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -67.0 -48.09 69.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 72.14 110.946 -179.965 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -49.67 -48.96 49.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 72.02 110.881 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.36 -55.88 13.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.491 . . . . 75.13 111.125 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.54 -40.88 39.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.21 -0.45 . . . . 54.3 110.84 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 60' ' ' PHE . 36.4 t -80.27 -25.28 11.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 72.4 111.15 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 74.22 110.901 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.557 HG11 HG23 ' A' ' 74' ' ' ILE . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.87 0.367 . . . . 73.32 111.081 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.609 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -81.76 161.14 62.18 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.552 0.691 . . . . 43.12 111.071 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.609 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.5 Cg_endo -69.76 -6.98 19.89 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.706 2.271 . . . . 72.52 112.311 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -99.82 -37.8 8.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 71.53 110.89 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -57.04 -62.17 1.94 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.143 -0.48 . . . . 71.33 110.879 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.7 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -43.73 -68.09 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 74.21 111.102 179.963 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.5 m -49.08 -39.1 11.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.111 -0.495 . . . . 71.12 111.092 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -61.42 -37.77 84.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 74.41 110.825 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.487 HG22 ' HB2' ' A' ' 121' ' ' ASP . 97.2 t -70.67 -38.39 72.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.274 -0.421 . . . . 74.5 111.127 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.9 OUTLIER -69.83 -33.22 72.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 54.24 110.899 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -89.75 -19.17 25.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 74.11 110.886 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.2 ttmm -75.85 -51.62 12.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.265 -0.425 . . . . 71.23 110.861 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.838 HD13 HD12 ' A' ' 120' ' ' LEU . 7.3 mt -91.49 14.47 14.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.245 -0.434 . . . . 64.35 110.922 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.02 43.19 29.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.439 . . . . 54.04 110.915 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.805 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.3 mm? -79.18 86.07 5.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.099 -0.5 . . . . 70.21 110.925 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.593 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -46.85 155.8 0.24 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 63.52 111.14 179.92 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.61 -22.24 61.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 75.24 110.991 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -77.34 -54.25 6.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 73.01 110.949 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.593 ' H ' HG23 ' A' ' 84' ' ' THR . 0.1 OUTLIER -65.5 -51.75 57.77 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.181 -0.463 . . . . 64.1 110.969 179.899 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.428 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -53.91 -32.68 54.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 73.15 111.021 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 13.7 t -80.34 -35.8 35.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 62.4 110.842 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -75.77 -21.13 57.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.088 -0.506 . . . . 63.23 110.896 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.728 ' CD1' HD12 ' A' ' 127' ' ' LEU . 55.7 mt -104.93 -62.35 2.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 61.13 111.112 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.54 ' HB3' HG23 ' A' ' 113' ' ' THR . 7.4 m-85 -75.31 -61.58 1.85 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 75.43 110.921 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 113.17 48.16 0.62 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.723 -0.751 . . . . 44.31 112.422 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.455 ' C ' ' HB2' ' A' ' 98' ' ' ALA . . . -69.78 -41.06 74.95 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.732 -0.747 . . . . 41.52 112.436 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 100.87 -155.85 19.27 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.76 -0.733 . . . . 71.53 112.533 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.5 t -80.56 -70.25 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 62.22 111.161 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -84.9 41.24 0.85 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.112 -0.494 . . . . 71.14 110.913 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.455 ' HB2' ' C ' ' A' ' 94' ' ' GLY . . . -61.61 -73.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 55.14 111.041 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -40.36 -41.68 1.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 75.24 110.871 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -60.1 -75.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 74.31 110.893 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.603 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 10.5 mtt180 -48.5 -47.9 38.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 64.23 110.886 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.572 ' HB3' HD12 ' A' ' 74' ' ' ILE . 10.5 m-85 -55.02 -37.78 67.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 64.35 110.943 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -53.3 -31.84 45.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 74.53 110.919 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.84 -20.5 14.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.116 -0.493 . . . . 61.22 110.909 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.63 25.41 13.58 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.731 -0.747 . . . . 73.05 112.541 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -98.38 -5.31 32.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.884 0.373 . . . . 71.23 110.909 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.603 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -118.02 17.17 14.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 22.02 111.093 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.448 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 0.0 OUTLIER -126.32 54.01 10.37 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.572 0.701 . . . . 71.14 110.948 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.506 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.2 Cg_endo -69.66 39.79 0.28 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.705 2.27 . . . . 64.45 112.34 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.736 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.3 m170 71.0 35.51 0.09 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.546 0.689 . . . . 74.34 110.898 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.736 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.2 Cg_endo -69.75 -164.05 0.12 Allowed 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.641 2.228 . . . . 74.13 112.353 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.501 ' O ' HD13 ' A' ' 116' ' ' LEU . 1.5 m -89.17 -23.84 22.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 63.14 110.831 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.54 HG23 ' HB3' ' A' ' 92' ' ' PHE . 21.1 m -61.49 -45.95 92.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.114 -0.494 . . . . 73.42 111.139 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 44.0 mm -56.35 -43.38 77.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 62.53 111.064 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.517 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -69.24 -33.75 73.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.142 -0.481 . . . . 73.22 110.873 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.712 ' HG ' HD12 ' A' ' 130' ' ' ILE . 7.5 mp -74.39 -38.12 63.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.235 -0.438 . . . . 74.04 110.918 179.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.7 HD13 HG22 ' A' ' 74' ' ' ILE . 33.7 mt -68.46 -51.42 43.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 65.23 110.974 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.559 ' HG3' HG13 ' A' ' 119' ' ' VAL . 14.7 ptp180 -50.33 -34.46 23.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 60.54 110.864 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.785 HG23 HD13 ' A' ' 126' ' ' LEU . 21.7 m -91.75 -19.98 6.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.224 -0.443 . . . . 73.22 111.085 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.838 HD12 HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -72.78 -44.58 61.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.171 -0.468 . . . . 72.21 110.92 179.963 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . 0.487 ' HB2' HG22 ' A' ' 77' ' ' VAL . 9.9 t0 -48.54 -29.45 4.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 72.41 110.794 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -91.78 -30.16 16.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.465 . . . . 73.22 110.894 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.618 ' O ' HD13 ' A' ' 120' ' ' LEU . 19.1 m-70 -128.06 98.37 27.2 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.552 0.692 . . . . 61.53 110.857 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.535 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.4 Cg_endo -69.8 3.93 2.51 Favored 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.652 2.235 . . . . 63.34 112.357 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -115.2 -12.58 11.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.257 -0.429 . . . . 74.54 110.878 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.785 HD13 HG23 ' A' ' 119' ' ' VAL . 2.1 mt -50.42 -48.53 56.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 71.22 110.924 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.728 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.67 -29.47 7.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 64.0 110.978 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.476 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.3 m-80 -86.85 -26.9 23.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 73.41 110.902 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.437 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.9 OUTLIER -96.89 7.81 45.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 71.44 110.885 -180.0 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.712 HD12 ' HG ' ' A' ' 116' ' ' LEU . 7.8 pt -128.06 -34.32 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 75.14 111.103 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.476 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 0.9 OUTLIER . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.253 -0.431 . . . . 65.42 110.858 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.594 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 1.4 mmt . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.893 0.378 . . . . 71.03 110.883 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.66 -169.2 0.41 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 75.44 110.893 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.1 p 177.64 58.39 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.641 0.734 . . . . 43.34 110.844 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 1.94 3.95 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.71 2.274 . . . . 71.42 112.348 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.604 HG21 ' CD ' ' A' ' 42' ' ' GLU . 23.8 m -92.78 -37.28 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 73.21 111.184 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -127.26 -33.46 2.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.155 -0.475 . . . . 61.32 110.88 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 66.4 57.67 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 72.33 110.806 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 93.4 mm-40 -121.3 -75.92 0.59 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.224 -0.444 . . . . 75.22 110.914 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -99.09 -114.74 3.55 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.682 -0.771 . . . . 52.11 112.477 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.594 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 7.6 pt-20 -174.3 98.07 0.1 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.803 0.335 . . . . 70.42 110.866 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.561 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -59.63 107.4 0.59 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.201 -0.454 . . . . 75.52 110.824 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 6.6 p -146.7 127.44 6.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 64.13 111.157 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.606 ' N ' HD23 ' A' ' 35' ' ' LEU . 5.8 p -48.61 135.81 14.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.449 . . . . 73.31 110.86 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.435 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 174.41 77.29 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.784 -0.722 . . . . 74.04 112.531 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.435 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.7 OUTLIER -33.71 141.35 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.897 0.379 . . . . 74.44 111.102 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.17 -168.14 2.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.441 . . . . 73.34 110.939 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -93.2 116.25 28.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.271 -0.422 . . . . 75.12 110.913 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.78 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.6 mm -107.91 91.27 7.44 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.653 0.739 . . . . 71.03 111.058 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.477 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 54.4 Cg_endo -69.71 103.85 1.22 Allowed 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.688 2.258 . . . . 61.1 112.379 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -68.72 -34.2 75.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 63.41 110.926 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.529 HG21 ' HG2' ' A' ' 25' ' ' ARG . 27.5 m -128.05 147.37 50.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.107 -0.497 . . . . 61.12 111.077 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -141.62 47.78 1.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 73.4 110.91 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.18 -68.7 0.55 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.116 -0.493 . . . . 71.45 110.863 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -132.32 -42.92 0.17 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.708 -0.758 . . . . 64.21 112.404 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.529 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -102.05 40.46 1.33 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.842 0.353 . . . . 74.32 110.87 -179.803 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.41 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 8.7 tttm -50.08 113.9 0.97 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 73.32 110.91 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.577 HG21 ' CD2' ' A' ' 60' ' ' PHE . 2.1 t -134.65 94.76 3.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 73.42 111.151 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.477 ' HA ' ' HA ' ' A' ' 19' ' ' PRO . 0.8 OUTLIER -82.15 140.29 16.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 73.31 111.122 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.78 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -86.46 63.32 7.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 62.31 110.983 179.929 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -41.6 105.22 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 71.22 110.852 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.522 ' O ' HD13 ' A' ' 32' ' ' ILE . . . 115.37 62.46 0.37 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.737 -0.744 . . . . 72.21 112.516 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.618 HD11 ' CB ' ' A' ' 29' ' ' LEU . 19.9 mm -118.05 93.3 2.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.827 0.346 . . . . 61.5 111.147 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.81 152.3 38.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 61.35 110.907 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.58 -109.42 0.34 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.689 -0.767 . . . . 52.54 112.46 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.741 HD12 ' HB ' ' A' ' 44' ' ' ILE . 51.6 mt -156.76 86.31 0.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.805 0.336 . . . . 71.4 110.881 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.47 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.77 159.85 30.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 74.14 110.922 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 32.3 t -164.05 -46.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.088 -0.505 . . . . 73.4 110.92 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.0 m -120.37 -47.05 2.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.198 -0.455 . . . . 53.44 111.105 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -87.96 171.45 10.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 71.53 110.811 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -137.64 9.99 2.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.218 -0.446 . . . . 74.13 110.878 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -99.24 -62.73 1.2 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 54.2 110.89 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.604 ' CD ' HG21 ' A' ' 5' ' ' VAL . 14.4 tp10 -76.95 61.56 1.97 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 65.02 110.866 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.1 p -99.54 158.94 15.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 74.12 110.835 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.741 ' HB ' HD12 ' A' ' 35' ' ' LEU . 22.8 mm -140.95 139.75 33.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.153 -0.476 . . . . 74.12 111.17 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.7 mtm -145.87 131.82 19.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 73.23 110.902 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 44.0 m-20 -84.06 -169.78 2.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 64.13 110.857 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.19 -58.24 8.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 53.33 110.873 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.1 -55.8 24.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.191 -0.459 . . . . 74.32 110.867 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.47 -58.97 4.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 70.33 110.87 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.3 t -55.42 -38.41 68.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.15 -0.477 . . . . 71.31 110.826 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.09 -45.81 89.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 72.14 110.821 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.3 -58.12 6.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 63.45 111.159 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -54.02 -46.88 71.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 75.51 110.892 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.411 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -64.67 -50.52 66.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.125 -0.489 . . . . 72.25 110.883 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.39 -39.63 57.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.255 -0.43 . . . . 62.54 111.128 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.754 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.4 mt-30 -71.94 -67.56 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.248 -0.433 . . . . 50.13 110.847 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.467 HG23 ' N ' ' A' ' 58' ' ' LYS . 21.9 m -46.77 -41.88 5.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 74.13 111.148 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.467 ' N ' HG23 ' A' ' 57' ' ' VAL . 10.0 mmmm -65.94 -50.83 62.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.246 -0.433 . . . . 73.22 110.89 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.43 -52.28 39.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 72.22 111.128 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.611 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -66.45 -42.67 87.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 72.14 110.869 -179.9 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 31.4 mtp85 -50.09 -52.98 30.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.154 -0.475 . . . . 72.02 110.892 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.26 -53.79 32.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 75.13 111.138 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.0 -39.48 26.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.293 -0.412 . . . . 54.3 110.813 -179.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 60' ' ' PHE . 60.3 t -80.7 -28.13 11.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 72.4 111.088 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 74.22 110.877 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 16.5 m . . . . . 0 C--O 1.23 0.053 0 CA-C-O 120.862 0.363 . . . . 73.32 111.128 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.559 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -105.57 159.75 28.43 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.653 0.74 . . . . 43.12 111.162 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.559 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.3 Cg_endo -69.76 -8.12 22.8 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.699 2.266 . . . . 72.52 112.356 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -97.69 -35.33 10.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 71.53 110.853 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -57.43 -60.02 4.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 71.33 110.874 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.895 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -45.74 -68.41 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.18 -0.463 . . . . 74.21 111.124 -179.965 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -48.2 -39.51 9.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.435 . . . . 71.12 111.166 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -60.18 -47.51 85.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.438 . . . . 74.41 110.875 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.562 HG22 ' HB2' ' A' ' 121' ' ' ASP . 95.0 t -60.49 -38.82 79.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 74.5 111.168 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.528 HH22 HG21 ' A' ' 113' ' ' THR . 0.4 OUTLIER -63.66 -60.05 3.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 54.24 110.939 -179.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.31 -21.22 66.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.475 . . . . 74.11 110.899 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -70.32 -54.2 13.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.267 -0.424 . . . . 71.23 110.918 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.816 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.1 mt -91.29 14.84 13.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 64.35 110.931 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 30.5 m 53.89 37.52 26.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.159 -0.473 . . . . 54.04 110.869 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.816 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.8 mm? -79.69 83.82 5.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 70.21 110.912 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.604 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.19 157.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 63.52 111.137 179.906 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -56.45 -23.13 36.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.219 -0.446 . . . . 75.24 110.885 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.63 -48.54 13.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 73.01 110.916 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.604 ' H ' HG23 ' A' ' 84' ' ' THR . 43.4 tt0 -61.63 -55.72 27.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.218 -0.447 . . . . 64.1 110.892 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.428 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -49.15 -32.45 10.1 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.184 -0.462 . . . . 73.15 111.087 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 5.6 p -80.54 -35.19 34.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 62.4 110.86 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -73.09 -23.7 60.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.084 -0.507 . . . . 63.23 110.846 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.77 HG23 ' HB3' ' A' ' 131' ' ' ARG . 19.3 mm -105.19 -63.02 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 61.13 111.09 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.576 ' HB3' HG23 ' A' ' 113' ' ' THR . 3.8 m-85 -74.62 -64.36 1.05 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.228 -0.442 . . . . 75.43 110.911 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 116.78 47.56 0.48 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.706 -0.759 . . . . 44.31 112.459 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -67.42 -35.34 87.01 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.768 -0.73 . . . . 41.52 112.443 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.31 -119.4 5.67 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.756 -0.735 . . . . 71.53 112.541 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 97' ' ' ASN . 0.1 OUTLIER -120.46 -61.57 2.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.859 0.362 . . . . 62.22 111.056 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.48 ' N ' HG22 ' A' ' 96' ' ' VAL . 1.0 OUTLIER -86.15 43.97 1.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.198 -0.455 . . . . 71.14 110.912 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.29 -75.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.144 -0.48 . . . . 55.14 111.125 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -41.81 -39.88 1.89 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 75.24 110.837 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.2 m -59.95 -76.22 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.116 -0.493 . . . . 74.31 110.836 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.622 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 30.1 mtt180 -50.34 -44.66 54.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 64.23 110.884 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.725 ' HB3' HD12 ' A' ' 74' ' ' ILE . 8.2 m-85 -55.86 -37.21 68.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 64.35 110.937 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -51.8 -29.26 18.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.1 -0.5 . . . . 74.53 110.867 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -107.16 -22.25 12.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 61.22 110.922 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.39 27.0 9.53 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.664 -0.779 . . . . 73.05 112.462 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 -98.34 -6.64 30.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.842 0.353 . . . . 71.23 110.843 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.622 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -110.51 10.57 23.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 22.02 111.123 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.45 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -124.19 57.2 13.02 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.579 0.704 . . . . 71.14 110.91 -179.895 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.523 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.9 Cg_endo -69.74 35.87 0.22 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.635 2.223 . . . . 64.45 112.408 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.762 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER 73.67 32.56 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.634 0.731 . . . . 74.34 110.894 179.934 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.762 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.0 Cg_endo -69.72 -164.02 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.721 2.28 . . . . 74.13 112.351 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.32 -30.95 21.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.473 . . . . 63.14 110.852 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.739 HG22 ' CD1' ' A' ' 117' ' ' LEU . 74.7 m -53.48 -48.08 69.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 73.42 111.101 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.411 HD11 ' HB2' ' A' ' 108' ' ' GLN . 40.2 mm -55.19 -46.27 77.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.45 . . . . 62.53 111.189 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.505 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -63.39 -29.14 70.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.149 -0.478 . . . . 73.22 110.894 179.831 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.549 ' CD2' HD12 ' A' ' 130' ' ' ILE . 6.4 mp -79.69 -42.45 24.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.203 -0.453 . . . . 74.04 110.862 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.895 HD13 HG22 ' A' ' 74' ' ' ILE . 3.8 mt -61.19 -49.71 76.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.451 . . . . 65.23 110.863 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.558 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.3 ptp180 -52.85 -37.22 59.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 60.54 110.859 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.558 HG13 ' HG3' ' A' ' 118' ' ' ARG . 32.8 m -90.87 -11.35 9.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.222 -0.445 . . . . 73.22 111.108 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.743 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -81.71 -40.23 23.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 72.21 110.912 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . 0.562 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.5 OUTLIER -50.44 -30.23 12.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 72.41 110.872 179.864 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -98.09 -19.26 18.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 73.22 110.876 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.743 ' O ' HD13 ' A' ' 120' ' ' LEU . 57.1 m-70 -129.64 88.89 48.35 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.607 0.718 . . . . 61.53 110.917 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.692 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.7 Cg_endo -69.75 2.17 3.77 Favored 'Trans proline' 0 N--CA 1.466 -0.13 0 C-N-CA 122.68 2.253 . . . . 63.34 112.351 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -115.75 -12.59 11.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 74.54 110.872 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.658 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.7 tp -54.26 -46.46 72.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 71.22 110.892 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.442 ' HB3' HD11 ' A' ' 120' ' ' LEU . 0.9 OUTLIER -48.61 -30.62 5.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.165 -0.47 . . . . 64.0 110.896 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.464 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.2 m-80 -85.19 -31.06 23.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 73.41 110.889 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.424 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.9 OUTLIER -89.75 4.41 49.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 71.44 110.86 -179.948 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.658 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.8 pt -123.63 -34.84 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.477 . . . . 75.14 111.157 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.77 ' HB3' HG23 ' A' ' 91' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 65.42 110.873 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.446 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.85 0.357 . . . . 71.03 110.895 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.43 -169.71 0.46 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.261 -0.427 . . . . 75.44 110.871 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.417 ' O ' ' N ' ' A' ' 7' ' ' HIS . 1.9 p 176.7 59.42 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.61 0.719 . . . . 43.34 110.937 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.7 1.74 4.13 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.664 2.242 . . . . 71.42 112.371 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.596 HG21 ' CD ' ' A' ' 42' ' ' GLU . 22.8 m -92.93 -37.35 8.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 73.21 111.148 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -127.0 -33.52 2.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 61.32 110.878 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.417 ' N ' ' O ' ' A' ' 3' ' ' CYS . 15.9 m-70 66.6 57.56 0.68 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.23 -0.441 . . . . 72.33 110.84 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -123.49 -75.78 0.6 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.278 -0.419 . . . . 75.22 110.869 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.56 -116.05 3.02 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.783 -0.722 . . . . 52.11 112.484 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.446 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 8.0 pt-20 -176.65 94.82 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.768 0.318 . . . . 70.42 110.929 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.597 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.3 ptp -54.62 106.19 0.2 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 75.52 110.809 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.442 HG12 ' O ' ' A' ' 10' ' ' GLU . 4.2 p -143.27 124.44 10.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 64.13 111.128 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.614 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.1 p -48.75 132.05 17.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 73.31 110.897 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.409 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.98 81.93 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.763 -0.732 . . . . 74.04 112.516 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.414 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -36.88 146.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.848 0.356 . . . . 74.44 111.154 -179.933 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.86 -165.51 1.65 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.183 -0.462 . . . . 73.34 110.94 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.682 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -95.19 116.76 29.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 75.12 110.871 179.841 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.718 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.1 mm -107.52 92.89 9.07 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.687 0.756 . . . . 71.03 111.112 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.411 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.4 Cg_endo -69.85 97.1 0.63 Allowed 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.651 2.234 . . . . 61.1 112.343 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.432 ' HB3' HG23 ' A' ' 27' ' ' THR . 18.5 t80 -62.94 -38.54 91.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 63.41 110.899 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.478 HG21 ' HG2' ' A' ' 25' ' ' ARG . 17.0 m -128.91 144.53 51.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 61.12 111.167 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -133.89 43.43 2.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.282 -0.417 . . . . 73.4 110.916 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.47 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -129.28 -68.38 0.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.154 -0.476 . . . . 71.45 110.884 -179.907 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -136.53 -46.04 0.08 OUTLIER Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.674 -0.774 . . . . 64.21 112.47 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.478 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.32 39.77 1.09 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.857 0.361 . . . . 74.32 110.885 -179.895 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.401 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 12.7 tttt -52.32 115.42 1.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 73.32 110.931 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.432 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -129.06 93.32 3.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.261 -0.427 . . . . 73.42 111.13 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.682 HG11 ' HB2' ' A' ' 17' ' ' ASP . 46.4 t -76.63 127.53 37.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.449 . . . . 73.31 111.117 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.741 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.71 51.22 2.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 62.31 110.95 179.945 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.2 mttp -37.74 107.64 0.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 71.22 110.88 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.67 47.46 0.4 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.791 -0.718 . . . . 72.21 112.497 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.58 HD11 ' HB3' ' A' ' 29' ' ' LEU . 16.7 mm -107.93 92.12 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.799 0.333 . . . . 61.5 111.2 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.05 154.07 38.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.456 . . . . 61.35 110.868 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.25 -107.8 0.29 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.708 -0.758 . . . . 52.54 112.493 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.757 HD12 ' HB ' ' A' ' 44' ' ' ILE . 45.1 mt -156.99 87.23 0.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.743 0.306 . . . . 71.4 110.856 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.434 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -162.62 159.47 24.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.195 -0.457 . . . . 74.14 110.929 179.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 36.1 t -168.56 -38.86 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.078 -0.51 . . . . 73.4 110.881 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.404 HG13 ' N ' ' A' ' 39' ' ' HIS . 2.5 p -124.05 -47.02 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 53.44 111.146 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.404 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -91.1 171.76 9.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 71.53 110.891 179.924 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.8 p -137.3 9.58 2.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 74.13 110.831 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -100.38 -62.67 1.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 54.2 110.926 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.596 ' CD ' HG21 ' A' ' 5' ' ' VAL . 13.4 tp10 -76.73 61.68 1.89 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 65.02 110.865 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.4 p -99.08 159.5 14.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 74.12 110.881 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.757 ' HB ' HD12 ' A' ' 35' ' ' LEU . 21.3 mm -143.85 140.06 25.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 74.12 111.121 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.7 mtt -143.27 135.11 26.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.439 . . . . 73.23 110.859 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -86.89 -169.5 2.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.187 -0.46 . . . . 64.13 110.921 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.83 -60.87 2.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.166 -0.47 . . . . 53.33 110.961 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -52.29 -57.07 10.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 74.32 110.843 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -50.84 -58.98 4.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 70.33 110.894 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.8 t -53.89 -40.97 67.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 71.31 110.865 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.93 -44.73 87.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.148 -0.478 . . . . 72.14 110.889 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.72 -60.45 3.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.456 . . . . 63.45 111.034 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.436 ' CZ ' HG11 ' A' ' 57' ' ' VAL . 20.6 t80 -53.56 -47.51 69.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 75.51 110.936 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.43 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.75 -48.36 79.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 72.25 110.874 179.925 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.45 -42.9 64.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 62.54 111.01 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.741 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.6 mt-30 -69.55 -66.16 0.62 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 50.13 110.968 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.436 HG11 ' CZ ' ' A' ' 53' ' ' PHE . 17.9 m -47.3 -35.94 3.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.241 -0.436 . . . . 74.13 111.083 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 mmmt -69.79 -51.32 34.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.201 -0.454 . . . . 73.22 110.865 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.97 -52.04 53.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.447 . . . . 72.22 111.163 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.635 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.2 OUTLIER -65.41 -46.1 81.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 72.14 110.863 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.93 -52.39 33.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.107 -0.497 . . . . 72.02 110.85 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.87 -54.41 35.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 75.13 111.119 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.06 -41.19 34.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.221 -0.445 . . . . 54.3 110.867 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 60' ' ' PHE . 41.9 t -78.86 -27.15 13.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.081 -0.509 . . . . 72.4 111.096 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 74.22 110.915 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 19.1 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.793 0.33 . . . . 73.32 111.127 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.509 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -104.22 158.18 32.47 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.639 0.733 . . . . 43.12 111.091 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.564 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.6 Cg_endo -69.7 -7.46 21.09 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.668 2.245 . . . . 72.52 112.377 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -96.43 -39.1 9.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.158 -0.473 . . . . 71.53 110.943 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.429 ' CE1' ' HA ' ' A' ' 118' ' ' ARG . 11.8 t80 -55.31 -60.2 3.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.106 -0.497 . . . . 71.33 110.854 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.623 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -45.67 -69.72 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 74.21 111.15 -179.999 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.1 m -47.76 -38.01 6.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.129 -0.487 . . . . 71.12 111.151 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.1 mtmt -61.47 -45.79 92.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 74.41 110.886 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.626 HG22 ' HB2' ' A' ' 121' ' ' ASP . 69.5 t -61.93 -38.33 80.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 74.5 111.091 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.438 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -65.25 -56.61 11.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.28 -0.418 . . . . 54.24 110.822 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.6 pttt -67.17 -21.24 65.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.253 -0.431 . . . . 74.11 110.912 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -71.39 -53.24 14.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 71.23 110.871 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.836 ' HB2' HD23 ' A' ' 83' ' ' LEU . 14.1 mt -91.63 14.99 13.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.238 -0.437 . . . . 64.35 110.943 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.3 m 51.54 38.18 21.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 54.04 110.85 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.836 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.9 mm? -79.28 86.75 5.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 70.21 110.827 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.645 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.18 155.92 0.18 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 63.52 111.097 179.905 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -58.34 -21.65 50.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.173 -0.467 . . . . 75.24 110.91 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -80.68 -53.72 6.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 73.01 110.855 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.645 ' H ' HG23 ' A' ' 84' ' ' THR . 0.5 OUTLIER -63.08 -47.69 81.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 64.1 110.881 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.414 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -56.5 -32.53 65.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.119 -0.491 . . . . 73.15 111.028 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 26.3 p -80.57 -33.98 35.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.305 -0.407 . . . . 62.4 110.808 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -74.3 -25.7 59.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 63.23 110.881 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.726 ' CD1' HD12 ' A' ' 127' ' ' LEU . 49.7 mt -101.43 -59.76 3.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 61.13 111.132 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.551 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.7 m-85 -77.99 -62.86 1.54 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 75.43 110.86 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 111.98 50.39 0.59 Allowed Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.77 -0.728 . . . . 44.31 112.538 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -82.12 -44.61 7.49 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.772 -0.728 . . . . 41.52 112.525 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 109.96 167.33 19.82 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.724 -0.75 . . . . 71.53 112.461 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.502 HG13 ' N ' ' A' ' 97' ' ' ASN . 3.4 p -56.67 -50.62 73.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.845 0.355 . . . . 62.22 111.124 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.502 ' N ' HG13 ' A' ' 96' ' ' VAL . 12.0 p30 -86.18 33.99 0.62 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 71.14 110.934 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.407 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -64.26 -77.17 0.06 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 55.14 111.114 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.407 ' C ' ' O ' ' A' ' 98' ' ' ALA . 47.9 m-85 -37.75 -47.11 0.97 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 75.24 110.854 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.08 -75.39 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.149 -0.478 . . . . 74.31 110.916 -179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.548 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 17.2 mtt180 -46.82 -53.64 11.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.093 -0.503 . . . . 64.23 110.865 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.622 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.7 m-85 -49.6 -39.41 35.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 64.35 110.929 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -51.81 -40.55 60.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.114 -0.494 . . . . 74.53 110.913 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.18 -18.8 22.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.111 -0.495 . . . . 61.22 110.942 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.33 25.88 13.22 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.726 -0.749 . . . . 73.05 112.492 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -92.82 -28.65 16.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.847 0.356 . . . . 71.23 110.926 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.548 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -98.13 18.86 15.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 22.02 111.083 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.498 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.9 OUTLIER -121.01 53.87 3.65 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.607 0.718 . . . . 71.14 110.913 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.5 Cg_endo -69.75 27.06 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.652 2.235 . . . . 64.45 112.374 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.731 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.0 m170 70.87 36.02 0.1 Allowed Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 121.649 0.738 . . . . 74.34 110.919 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.731 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.3 Cg_endo -69.74 -165.28 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.608 2.205 . . . . 74.13 112.363 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 12.9 p -82.56 -32.72 28.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 63.14 110.882 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.551 HG23 ' HB3' ' A' ' 92' ' ' PHE . 17.3 m -49.02 -42.73 39.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 73.42 111.068 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.442 HD11 ' HG2' ' A' ' 108' ' ' GLN . 24.4 mm -60.76 -43.5 95.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.253 -0.431 . . . . 62.53 111.13 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.695 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -63.33 -29.67 70.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 73.22 110.929 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.695 HD12 ' HG3' ' A' ' 115' ' ' LYS . 8.1 mp -81.49 -47.61 12.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.236 -0.438 . . . . 74.04 110.9 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.623 HD13 HG22 ' A' ' 74' ' ' ILE . 34.9 mt -56.39 -47.81 78.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.448 . . . . 65.23 110.926 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.66 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.3 ptp180 -55.18 -36.09 65.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 60.54 110.815 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.66 HG13 ' HG3' ' A' ' 118' ' ' ARG . 19.9 m -95.91 0.22 10.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.287 -0.415 . . . . 73.22 111.15 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.754 HD12 HD13 ' A' ' 81' ' ' LEU . 0.5 OUTLIER -92.21 -38.29 12.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.105 -0.498 . . . . 72.21 110.915 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . 0.626 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.3 OUTLIER -52.45 -24.4 7.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 72.41 110.844 179.841 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.502 ' HD3' ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -100.66 -20.37 15.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.244 -0.434 . . . . 73.22 110.942 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.732 ' O ' HD13 ' A' ' 120' ' ' LEU . 51.0 m-70 -130.19 91.05 40.11 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.547 0.689 . . . . 61.53 110.935 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.673 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.8 Cg_endo -69.69 2.05 3.84 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.658 2.238 . . . . 63.34 112.326 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -116.45 -12.17 11.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.439 . . . . 74.54 110.924 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.653 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.8 tp -52.9 -47.4 67.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 71.22 110.955 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.726 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.8 pt? -49.7 -29.52 7.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.132 -0.485 . . . . 64.0 110.901 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.493 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.2 m-80 -86.08 -28.41 24.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.46 . . . . 73.41 110.855 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.433 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -93.71 5.36 51.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 71.44 110.936 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.653 HG23 ' O ' ' A' ' 126' ' ' LEU . 11.4 pt -124.8 -35.18 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 75.14 111.145 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.493 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.6 ptt-85 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 65.42 110.859 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mmt . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.817 0.341 . . . . 71.03 110.852 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.34 -169.14 0.43 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 75.44 110.926 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.0 p -179.83 59.7 0.1 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.611 0.72 . . . . 43.34 110.925 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -4.51 14.18 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.684 2.256 . . . . 71.42 112.332 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.543 HG12 ' N ' ' A' ' 6' ' ' CYS . 2.1 t -74.43 -62.17 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 73.21 111.14 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.543 ' N ' HG12 ' A' ' 5' ' ' VAL . 49.4 t -120.14 -18.58 8.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 61.32 110.861 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 63.65 79.88 0.25 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.252 -0.431 . . . . 72.33 110.848 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -138.52 -75.49 0.38 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 75.22 110.952 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.636 ' HA3' HG13 ' A' ' 38' ' ' VAL . . . -98.05 -114.27 3.32 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.678 -0.773 . . . . 52.11 112.481 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.46 ' HG2' HG11 ' A' ' 38' ' ' VAL . 5.7 pt-20 -170.62 93.94 0.2 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.801 0.334 . . . . 70.42 110.945 -179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.564 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.7 OUTLIER -54.18 98.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 75.52 110.874 -179.934 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 15.0 p -144.32 131.02 16.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 64.13 111.087 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.515 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.3 OUTLIER -44.91 122.75 3.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 73.31 110.831 -179.875 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.76 81.58 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.713 -0.756 . . . . 74.04 112.509 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.418 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.89 148.38 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.862 0.363 . . . . 74.44 111.153 -179.98 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.42 -165.95 1.8 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 73.34 110.939 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.688 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -96.81 116.98 30.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 75.12 110.859 179.833 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.725 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.9 mm -107.74 91.78 7.91 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.548 0.689 . . . . 71.03 111.096 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.455 ' HA ' HG22 ' A' ' 28' ' ' VAL . 54.0 Cg_endo -69.77 96.29 0.59 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.658 2.239 . . . . 61.1 112.359 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.441 ' HB3' HG23 ' A' ' 27' ' ' THR . 16.5 t80 -63.32 -37.6 87.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 63.41 110.956 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.504 HG21 ' HG2' ' A' ' 25' ' ' ARG . 16.4 m -128.78 147.22 50.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.111 -0.495 . . . . 61.12 111.204 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -144.19 37.22 1.25 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 73.4 110.867 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.455 ' HD3' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -128.01 -39.74 1.73 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.193 -0.458 . . . . 71.45 110.897 -179.892 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -156.76 -58.82 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.67 -0.776 . . . . 64.21 112.441 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.504 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -90.92 46.77 1.35 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.869 0.366 . . . . 74.32 110.888 -179.836 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.417 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 10.8 tttm -53.74 116.31 2.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 73.32 110.923 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.441 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -131.58 92.2 3.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.305 -0.407 . . . . 73.42 111.186 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.688 HG11 ' HB2' ' A' ' 17' ' ' ASP . 42.8 t -76.61 127.55 37.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 73.31 111.127 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.74 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.79 51.51 2.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 62.31 110.893 179.934 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 20.2 mttp -38.99 107.33 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.215 -0.448 . . . . 71.22 110.888 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.67 44.91 0.4 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.75 -0.738 . . . . 72.21 112.496 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.587 HG22 ' OH ' ' A' ' 36' ' ' TYR . 14.3 mm -105.58 90.09 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.885 0.374 . . . . 61.5 111.17 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.77 156.62 37.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 61.35 110.857 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.34 -106.65 0.27 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.784 -0.722 . . . . 52.54 112.507 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.762 HD12 ' HB ' ' A' ' 44' ' ' ILE . 65.2 mt -155.61 83.95 1.04 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.781 0.324 . . . . 71.4 110.899 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.587 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -169.99 149.66 3.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.257 -0.429 . . . . 74.14 110.972 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.2 t -167.47 25.74 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.109 -0.496 . . . . 73.4 110.859 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.636 HG13 ' HA3' ' A' ' 9' ' ' GLY . 1.9 p 179.29 -34.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 53.44 111.138 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -113.79 176.2 5.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.195 -0.457 . . . . 71.53 110.795 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.58 24.57 1.38 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.485 . . . . 74.13 110.877 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -100.82 -77.42 0.54 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 54.2 110.895 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -78.28 60.75 2.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.475 . . . . 65.02 110.892 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.0 p -87.9 162.77 16.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 74.12 110.892 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.762 ' HB ' HD12 ' A' ' 35' ' ' LEU . 21.1 mm -146.99 139.3 19.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 74.12 111.044 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.2 mtt -142.67 146.02 34.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 73.23 110.869 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.5 m-20 -95.56 -169.09 1.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.158 -0.473 . . . . 64.13 110.88 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -55.12 -60.53 3.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 53.33 110.886 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -52.67 -57.95 8.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.436 . . . . 74.32 110.877 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.53 -59.35 4.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 70.33 110.834 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.6 t -52.82 -42.39 65.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.187 -0.46 . . . . 71.31 110.815 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.25 -44.34 83.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.129 -0.487 . . . . 72.14 110.899 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.89 -61.76 1.97 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 63.45 111.157 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.437 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.8 t80 -52.44 -46.87 66.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.25 -0.432 . . . . 75.51 110.855 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.449 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.34 -49.57 73.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 72.25 110.889 179.935 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.49 -42.12 61.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 62.54 111.035 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.74 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.5 mt-30 -70.32 -66.9 0.54 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.272 -0.422 . . . . 50.13 110.961 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.449 HG22 ' HA ' ' A' ' 54' ' ' MET . 16.6 m -46.95 -35.64 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.449 . . . . 74.13 111.109 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.8 mmmm -70.42 -51.95 25.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 73.22 110.912 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.26 -51.49 53.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.277 -0.42 . . . . 72.22 111.143 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.613 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -66.41 -45.81 78.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 72.14 110.935 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.35 -46.86 56.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 72.02 110.863 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.21 -57.52 5.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 75.13 111.078 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.26 -39.2 13.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 54.3 110.85 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 60' ' ' PHE . 46.0 t -80.59 -31.28 12.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 72.4 111.126 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 74.22 110.928 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.574 HG22 HE22 ' A' ' 108' ' ' GLN . 4.7 m . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.822 0.344 . . . . 73.32 111.095 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.469 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -92.83 157.49 39.42 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.509 0.671 . . . . 43.12 111.077 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.712 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.6 Cg_endo -69.76 -6.33 18.35 Favored 'Trans proline' 0 C--N 1.34 0.121 0 C-N-CA 122.669 2.246 . . . . 72.52 112.35 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -92.45 -44.6 8.58 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.23 -0.441 . . . . 71.53 110.834 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -52.9 -62.22 1.79 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 71.33 110.904 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.712 HD11 ' HA ' ' A' ' 71' ' ' PRO . 0.3 OUTLIER -44.63 -69.97 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.142 -0.481 . . . . 74.21 111.095 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 26.7 m -48.28 -39.17 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.175 -0.466 . . . . 71.12 111.12 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -59.68 -47.21 86.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 74.41 110.898 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.413 HG22 ' HB2' ' A' ' 121' ' ' ASP . 98.7 t -60.29 -39.4 80.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 74.5 111.146 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.577 HH22 HG21 ' A' ' 113' ' ' THR . 0.7 OUTLIER -64.06 -60.39 3.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 54.24 110.793 -179.875 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -63.89 -22.72 67.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.257 -0.429 . . . . 74.11 110.864 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 14.2 ttmm -68.18 -54.71 15.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.462 . . . . 71.23 110.904 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.847 ' HB2' HD23 ' A' ' 83' ' ' LEU . 9.2 mt -91.6 15.91 11.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.241 -0.436 . . . . 64.35 110.902 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.88 39.53 26.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 54.04 110.811 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.847 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.5 mm? -79.34 86.15 5.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.144 -0.48 . . . . 70.21 110.937 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.645 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -44.95 156.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.247 -0.433 . . . . 63.52 111.109 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -59.04 -20.6 54.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 75.24 110.951 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -81.35 -53.69 6.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 73.01 110.909 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.645 ' H ' HG23 ' A' ' 84' ' ' THR . 4.0 tt0 -59.57 -48.66 80.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.47 . . . . 64.1 110.81 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.45 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -56.12 -32.87 64.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.178 -0.465 . . . . 73.15 111.11 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 28.6 t -79.42 -31.63 42.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 62.4 110.828 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -79.47 -24.24 42.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 63.23 110.894 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.727 ' CD1' HD12 ' A' ' 127' ' ' LEU . 50.7 mt -103.61 -62.07 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.481 . . . . 61.13 111.158 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.541 ' HB3' HG23 ' A' ' 113' ' ' THR . 5.7 m-85 -75.31 -64.16 1.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.173 -0.467 . . . . 75.43 110.85 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 116.73 49.33 0.43 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.718 -0.753 . . . . 44.31 112.519 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -82.95 -45.39 6.7 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.701 -0.761 . . . . 41.52 112.434 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . 0.403 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 109.66 166.89 20.05 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.762 -0.733 . . . . 71.53 112.489 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.5 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.7 p -50.91 -51.69 19.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.827 0.346 . . . . 62.22 111.096 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.5 ' N ' HG13 ' A' ' 96' ' ' VAL . 28.2 m-20 -87.23 40.21 0.91 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 71.14 110.886 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.404 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -63.86 -78.22 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.226 -0.443 . . . . 55.14 111.073 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.404 ' C ' ' O ' ' A' ' 98' ' ' ALA . 40.6 m-85 -38.2 -42.55 0.69 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.165 -0.471 . . . . 75.24 110.932 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.0 t -60.02 -74.81 0.07 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.181 -0.463 . . . . 74.31 110.851 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.518 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 34.6 mtt85 -49.64 -46.8 49.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.164 -0.471 . . . . 64.23 110.931 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -56.63 -35.47 68.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.149 -0.478 . . . . 64.35 110.886 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -77.86 -3.77 43.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 74.53 110.894 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.2 -19.1 10.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 61.22 110.927 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.84 19.83 35.79 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.703 -0.761 . . . . 73.05 112.495 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.1 m-20 -98.39 -29.51 13.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.764 0.316 . . . . 71.23 110.826 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.518 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -99.16 26.05 6.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 22.02 111.063 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.574 HE22 HG22 ' A' ' 69' ' ' VAL . 0.0 OUTLIER -126.37 47.51 2.44 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.606 0.717 . . . . 71.14 110.937 -179.982 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.553 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.4 Cg_endo -69.7 24.94 0.17 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.669 2.246 . . . . 64.45 112.333 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.736 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 15.2 t-160 69.98 35.15 0.1 OUTLIER Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.586 0.707 . . . . 74.34 110.857 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.736 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.2 Cg_endo -69.82 -165.31 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.711 2.274 . . . . 74.13 112.259 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.5 t -79.84 -29.86 40.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.161 -0.472 . . . . 63.14 110.882 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.577 HG21 HH22 ' A' ' 78' ' ' ARG . 39.7 m -52.41 -39.25 60.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.161 -0.472 . . . . 73.42 111.184 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.517 HD11 ' HG2' ' A' ' 108' ' ' GLN . 33.1 mm -63.45 -44.3 98.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.456 . . . . 62.53 111.138 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.708 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -65.16 -29.16 69.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.128 -0.487 . . . . 73.22 110.858 179.871 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.708 HD12 ' HG3' ' A' ' 115' ' ' LYS . 8.1 mp -81.94 -44.93 16.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.277 -0.42 . . . . 74.04 110.916 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.503 ' CD1' HG22 ' A' ' 113' ' ' THR . 39.8 mt -59.59 -48.27 82.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.456 . . . . 65.23 110.856 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.598 ' HG3' HG13 ' A' ' 119' ' ' VAL . 14.3 ptp180 -54.11 -37.61 64.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.228 -0.442 . . . . 60.54 110.928 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.598 HG13 ' HG3' ' A' ' 118' ' ' ARG . 27.4 m -91.88 -8.6 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 73.22 111.095 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.739 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -83.24 -40.06 20.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 72.21 110.917 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . 0.413 ' HB2' HG22 ' A' ' 77' ' ' VAL . 12.5 t0 -49.72 -31.31 11.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 72.41 110.873 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.93 -19.69 17.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 73.22 110.908 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.739 ' O ' HD13 ' A' ' 120' ' ' LEU . 34.9 m-70 -127.76 87.03 56.88 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.591 0.71 . . . . 61.53 110.875 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.707 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.9 Cg_endo -69.8 3.37 2.83 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.703 2.269 . . . . 63.34 112.35 180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -116.97 -12.7 10.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 74.54 110.92 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.663 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.1 tp -53.97 -46.68 71.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.466 . . . . 71.22 110.941 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.727 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.65 -29.43 7.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.459 . . . . 64.0 110.912 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.489 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.56 -27.93 23.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 73.41 110.864 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.428 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -94.15 4.96 53.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 71.44 110.955 179.941 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 126' ' ' LEU . 11.7 pt -124.24 -35.01 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 75.14 111.139 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.489 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.4 ptt-85 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 65.42 110.922 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.613 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.849 0.357 . . . . 71.03 110.949 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.75 -170.39 0.48 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 75.44 110.905 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 p 178.99 56.96 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.555 0.693 . . . . 43.34 110.904 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.403 ' HA ' ' CD2' ' A' ' 7' ' ' HIS . 53.4 Cg_endo -69.73 7.28 1.02 Allowed 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.658 2.239 . . . . 71.42 112.381 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.5 m -102.27 -43.3 9.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 73.21 111.114 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.9 -31.92 4.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.192 -0.458 . . . . 61.32 110.915 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.403 ' CD2' ' HA ' ' A' ' 4' ' ' PRO . 4.0 m-70 63.5 49.06 3.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.148 -0.478 . . . . 72.33 110.859 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 72.6 mm-40 -117.13 -75.6 0.58 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 75.22 110.881 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -93.76 -117.14 2.71 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.728 -0.749 . . . . 52.11 112.561 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.613 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 8.0 pt-20 -174.08 93.27 0.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.857 0.36 . . . . 70.42 110.887 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.54 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.2 ptp -52.65 106.1 0.15 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 75.52 110.931 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.428 HG12 ' O ' ' A' ' 10' ' ' GLU . 7.5 p -147.41 127.81 5.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.238 -0.437 . . . . 64.13 111.176 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.574 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -45.38 127.45 7.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 73.31 110.864 -179.781 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.95 81.74 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.741 -0.742 . . . . 74.04 112.467 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.412 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.38 147.34 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.887 0.375 . . . . 74.44 111.12 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.32 -165.77 1.77 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 73.34 110.906 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.672 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -96.38 116.66 29.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 75.12 110.856 179.918 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.698 ' O ' HD22 ' A' ' 29' ' ' LEU . 10.0 mm -107.62 92.44 8.62 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.644 0.735 . . . . 71.03 111.138 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.434 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.9 Cg_endo -69.78 96.88 0.61 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.688 2.259 . . . . 61.1 112.345 179.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.505 ' HB3' HG23 ' A' ' 27' ' ' THR . 18.3 t80 -62.65 -38.45 90.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 63.41 110.93 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.521 HG21 ' HG2' ' A' ' 25' ' ' ARG . 16.8 m -129.04 145.38 51.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.071 -0.513 . . . . 61.12 111.125 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -135.48 46.51 2.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 73.4 110.886 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.423 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -131.79 -68.39 0.64 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.163 -0.471 . . . . 71.45 110.908 -179.915 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -137.21 -42.71 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.718 -0.754 . . . . 64.21 112.463 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.521 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -98.03 39.4 1.23 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.852 0.358 . . . . 74.32 110.865 -179.883 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.407 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 12.8 tttm -51.64 117.27 2.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.287 -0.415 . . . . 73.32 110.915 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.505 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -129.66 92.15 3.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.257 -0.429 . . . . 73.42 111.119 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.672 HG11 ' HB2' ' A' ' 17' ' ' ASP . 40.4 t -76.77 127.18 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 73.31 111.189 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.76 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.83 51.92 2.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.474 . . . . 62.31 110.885 -179.993 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.1 mttm -39.14 106.94 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 71.22 110.899 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.91 45.3 0.38 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.795 -0.717 . . . . 72.21 112.498 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.575 HG22 ' OH ' ' A' ' 36' ' ' TYR . 14.4 mm -105.93 91.3 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.834 0.35 . . . . 61.5 111.195 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.85 158.59 33.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.246 -0.434 . . . . 61.35 110.848 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 163.11 -105.99 0.27 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.709 -0.758 . . . . 52.54 112.45 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.742 HD12 ' HB ' ' A' ' 44' ' ' ILE . 46.9 mt -156.67 83.4 0.96 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.789 0.328 . . . . 71.4 110.952 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.575 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -168.96 169.44 9.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.204 -0.453 . . . . 74.14 110.906 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.51 -33.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.061 -0.518 . . . . 73.4 110.909 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 p -120.23 -45.76 2.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 53.44 111.098 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -99.4 178.44 4.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 71.53 110.821 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 24.1 p -148.88 29.95 0.81 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.206 -0.452 . . . . 74.13 110.887 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -104.52 -77.27 0.58 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.453 . . . . 54.2 110.865 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -77.55 59.95 2.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.504 . . . . 65.02 110.881 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.7 p -83.74 158.88 21.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 74.12 110.832 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.742 ' HB ' HD12 ' A' ' 35' ' ' LEU . 28.1 mm -144.34 140.81 24.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.1 -0.5 . . . . 74.12 111.08 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.9 mtt -144.76 142.38 29.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.136 -0.484 . . . . 73.23 110.834 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.0 m-20 -90.76 -172.96 3.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 64.13 110.894 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.52 -62.1 1.84 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.47 . . . . 53.33 110.932 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -51.05 -58.17 6.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.155 -0.475 . . . . 74.32 110.885 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -49.13 -59.12 3.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 70.33 110.861 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.9 t -53.46 -42.05 66.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 71.31 110.895 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.24 -44.1 83.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.136 -0.484 . . . . 72.14 110.867 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.33 -61.37 2.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 63.45 111.048 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.455 ' CZ ' HG11 ' A' ' 57' ' ' VAL . 19.4 t80 -52.83 -46.66 67.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 75.51 110.873 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.43 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.55 -49.61 72.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.49 . . . . 72.25 110.853 180.0 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.61 -42.77 62.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.276 -0.42 . . . . 62.54 111.033 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.76 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.5 mt-30 -70.04 -66.79 0.55 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 50.13 110.879 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.455 HG11 ' CZ ' ' A' ' 53' ' ' PHE . 17.7 m -46.68 -35.63 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 74.13 111.134 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -70.56 -51.01 31.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.468 . . . . 73.22 110.857 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.74 -51.18 58.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.302 -0.408 . . . . 72.22 111.038 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.607 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -67.34 -45.09 77.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.25 -0.432 . . . . 72.14 110.894 -179.898 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 -50.63 -50.55 53.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.177 -0.465 . . . . 72.02 110.88 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.24 -56.26 12.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.452 . . . . 75.13 111.156 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -46.67 -42.99 17.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 54.3 110.892 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 60' ' ' PHE . 57.3 t -74.09 -34.33 38.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 72.4 111.146 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.882 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.612 HG22 HE22 ' A' ' 108' ' ' GLN . 15.7 m . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.856 0.36 . . . . 73.32 111.145 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -102.99 154.14 37.77 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.601 0.715 . . . . 43.12 111.118 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.597 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.6 Cg_endo -69.74 -7.67 21.65 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.721 2.281 . . . . 72.52 112.31 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -95.98 -38.92 10.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 71.53 110.88 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.531 ' O ' HG23 ' A' ' 77' ' ' VAL . 12.3 t80 -56.23 -59.98 4.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.49 . . . . 71.33 110.9 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.775 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -45.22 -68.79 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.104 -0.498 . . . . 74.21 111.16 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.6 m -48.75 -39.1 10.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 71.12 111.144 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -61.04 -38.19 85.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 74.41 110.875 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 73' ' ' PHE . 55.2 t -70.88 -37.15 67.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.247 -0.433 . . . . 74.5 111.163 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.6 OUTLIER -70.81 -33.16 70.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 54.24 110.857 -179.94 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.37 -20.1 24.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.195 -0.457 . . . . 74.11 110.936 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.474 ' HG2' HD23 ' A' ' 81' ' ' LEU . 1.2 ttmm -76.19 -51.5 11.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 71.23 110.956 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.812 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.3 mt -89.89 13.56 14.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.237 -0.438 . . . . 64.35 110.914 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.24 42.16 28.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 54.04 110.953 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.812 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.4 mm? -78.73 85.03 4.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.041 -0.527 . . . . 70.21 110.904 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.632 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.22 156.66 0.15 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.124 -0.489 . . . . 63.52 111.086 179.947 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -57.64 -23.01 48.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 75.24 110.911 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.0 mttm -79.47 -53.29 7.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 73.01 110.904 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.632 ' H ' HG23 ' A' ' 84' ' ' THR . 3.0 tt0 -63.66 -53.72 47.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 64.1 110.905 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.559 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -53.65 -36.31 61.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.087 -0.506 . . . . 73.15 111.147 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.7 t -79.01 -28.81 43.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 62.4 110.824 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -78.08 -29.56 49.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.108 -0.496 . . . . 63.23 110.885 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.77 HD12 ' HB3' ' A' ' 131' ' ' ARG . 18.3 mm -98.8 -58.24 3.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.096 -0.502 . . . . 61.13 111.18 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.547 ' HB3' HG23 ' A' ' 113' ' ' THR . 5.5 m-85 -77.11 -64.36 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 75.43 110.842 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 110.54 45.37 0.91 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.786 -0.721 . . . . 44.31 112.479 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.71 -45.04 93.95 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.67 -0.776 . . . . 41.52 112.513 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.04 172.23 21.75 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.72 -0.752 . . . . 71.53 112.464 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.675 HG13 ' H ' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -50.53 -66.52 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.873 0.368 . . . . 62.22 111.161 -179.992 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.675 ' H ' HG13 ' A' ' 96' ' ' VAL . 8.4 t30 -86.21 42.4 0.99 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.471 . . . . 71.14 110.945 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.41 -76.17 0.06 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.124 -0.489 . . . . 55.14 111.084 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -39.69 -39.49 0.77 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.433 . . . . 75.24 110.866 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.9 m -61.01 -76.31 0.05 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 74.31 110.89 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.607 ' HB3' ' HB2' ' A' ' 107' ' ' ALA . 29.0 mtt85 -50.04 -45.61 52.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 64.23 110.855 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.434 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.9 m-85 -57.6 -37.22 72.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 64.35 110.941 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -62.75 -16.92 59.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 74.53 110.86 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.94 -20.54 12.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.238 -0.437 . . . . 61.22 110.926 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.8 28.75 11.65 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.724 -0.75 . . . . 73.05 112.458 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -106.71 -8.55 16.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.846 0.355 . . . . 71.23 110.905 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.607 ' HB2' ' HB3' ' A' ' 101' ' ' ARG . . . -115.06 13.65 16.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 22.02 111.088 179.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.612 HE22 HG22 ' A' ' 69' ' ' VAL . 0.0 OUTLIER -126.48 55.72 14.75 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.618 0.723 . . . . 71.14 110.863 -179.899 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.502 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.5 Cg_endo -69.78 36.54 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.661 2.241 . . . . 64.45 112.358 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . 0.753 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 1.0 OUTLIER 72.05 33.92 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.551 0.691 . . . . 74.34 110.828 179.917 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . 0.753 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.2 Cg_endo -69.7 -164.14 0.12 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.722 2.281 . . . . 74.13 112.364 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.35 -32.81 32.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 63.14 110.861 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.547 HG23 ' HB3' ' A' ' 92' ' ' PHE . 22.7 m -52.7 -54.09 38.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.158 -0.474 . . . . 73.42 111.18 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.467 HD11 ' HB2' ' A' ' 108' ' ' GLN . 46.4 mm -50.95 -45.24 28.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 62.53 111.165 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.484 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -63.75 -29.51 70.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 73.22 110.89 179.867 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.484 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.3 mp -80.01 -49.86 11.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.199 -0.455 . . . . 74.04 110.917 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.775 HD13 HG22 ' A' ' 74' ' ' ILE . 20.6 mt -55.42 -47.97 75.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 65.23 110.91 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.682 ' HG3' HG13 ' A' ' 119' ' ' VAL . 17.3 ptp180 -55.18 -35.54 64.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 60.54 110.908 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.682 HG13 ' HG3' ' A' ' 118' ' ' ARG . 18.8 m -96.95 0.32 10.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 73.22 111.132 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.736 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.7 OUTLIER -93.1 -36.52 12.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 72.21 110.878 179.95 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -53.03 -24.37 9.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.12 -0.491 . . . . 72.41 110.882 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.481 ' HD3' ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -99.7 -20.2 16.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 73.22 110.935 179.982 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.736 ' O ' HD13 ' A' ' 120' ' ' LEU . 74.4 m-70 -132.52 93.4 25.02 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.604 0.716 . . . . 61.53 110.934 179.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.605 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.7 Cg_endo -69.77 -0.02 6.32 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.7 2.267 . . . . 63.34 112.333 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -114.31 -11.34 12.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.259 -0.428 . . . . 74.54 110.902 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.682 ' O ' HG23 ' A' ' 130' ' ' ILE . 7.8 tp -53.27 -49.15 67.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.122 -0.49 . . . . 71.22 110.861 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.743 HD13 HD11 ' A' ' 83' ' ' LEU . 2.0 pt? -51.28 -28.86 13.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.276 -0.42 . . . . 64.0 110.863 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.487 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.36 -27.11 24.46 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.216 -0.447 . . . . 73.41 110.844 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.402 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.1 pp20? -94.12 2.46 55.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.269 -0.423 . . . . 71.44 110.899 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.682 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.3 pt -121.47 -34.26 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 75.14 111.176 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.77 ' HB3' HD12 ' A' ' 91' ' ' ILE . 2.5 ptt-85 . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.104 -0.498 . . . . 65.42 110.826 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mtt . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.867 0.365 . . . . 71.03 110.88 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.34 -170.58 0.53 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 75.44 110.846 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.435 ' O ' ' N ' ' A' ' 7' ' ' HIS . 0.1 OUTLIER 174.27 59.1 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.596 0.713 . . . . 43.34 110.847 179.922 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -2.64 10.54 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.689 2.259 . . . . 71.42 112.328 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.466 HG23 ' N ' ' A' ' 6' ' ' CYS . 30.5 m -84.08 -43.14 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.255 -0.429 . . . . 73.21 111.106 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.466 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.8 OUTLIER -125.77 -28.62 3.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 61.32 110.888 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.435 ' N ' ' O ' ' A' ' 3' ' ' CYS . 21.3 m-70 67.66 46.31 1.35 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 72.33 110.878 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -107.6 -74.05 0.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.434 . . . . 75.22 110.872 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.81 -134.72 8.55 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.719 -0.753 . . . . 52.11 112.483 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.477 ' O ' HG12 ' A' ' 12' ' ' VAL . 5.9 pt-20 -155.19 88.26 1.16 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 70.42 110.863 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.551 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -48.97 105.5 0.08 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 75.52 110.895 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.477 HG12 ' O ' ' A' ' 10' ' ' GLU . 3.9 p -142.01 126.65 16.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 64.13 111.145 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.586 ' N ' HD23 ' A' ' 35' ' ' LEU . 2.4 p -49.09 130.98 19.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 73.31 110.865 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.411 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 178.94 80.76 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.748 -0.739 . . . . 74.04 112.464 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.415 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.12 146.83 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.93 0.395 . . . . 74.44 111.108 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.8 -165.51 1.66 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.124 -0.489 . . . . 73.34 110.893 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.679 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -95.59 116.97 29.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.235 -0.439 . . . . 75.12 110.907 179.861 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.713 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.2 mm -107.59 91.96 7.93 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.652 0.739 . . . . 71.03 111.142 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.431 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.9 Cg_endo -69.76 96.89 0.61 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.654 2.236 . . . . 61.1 112.344 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.425 ' HB3' HG23 ' A' ' 27' ' ' THR . 15.0 t80 -64.5 -36.92 85.74 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 63.41 110.919 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.491 HG21 ' HG2' ' A' ' 25' ' ' ARG . 16.7 m -128.87 146.79 50.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 61.12 111.139 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.8 p90 -143.87 36.18 1.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 73.4 110.882 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.55 -40.23 2.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 71.45 110.854 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -157.42 -57.92 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.713 -0.756 . . . . 64.21 112.478 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.491 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -91.18 46.31 1.3 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.876 0.37 . . . . 74.32 110.882 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.414 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 14.4 tttm -53.09 116.48 2.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 73.32 110.887 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.425 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -130.74 92.55 3.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 73.42 111.123 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.679 HG11 ' HB2' ' A' ' 17' ' ' ASP . 44.5 t -77.07 127.55 38.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 73.31 111.073 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.742 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -85.05 51.43 2.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 62.31 110.893 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 29' ' ' LEU . 19.0 mttm -38.08 107.69 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 71.22 110.933 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 119.45 46.58 0.4 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.764 -0.732 . . . . 72.21 112.534 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.576 HD11 ' HB3' ' A' ' 29' ' ' LEU . 15.1 mm -107.73 91.69 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.884 0.373 . . . . 61.5 111.117 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.27 154.61 38.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 61.35 110.883 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 168.32 -109.33 0.33 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.761 -0.733 . . . . 52.54 112.502 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.74 HD12 ' HB ' ' A' ' 44' ' ' ILE . 53.8 mt -156.98 87.0 0.98 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.856 0.36 . . . . 71.4 110.897 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -159.73 160.18 33.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 74.14 110.921 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.7 t -171.82 -40.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.137 -0.483 . . . . 73.4 110.905 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 39' ' ' HIS . 2.6 p -120.9 -46.54 2.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 53.44 111.139 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.407 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -92.1 170.65 9.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.494 . . . . 71.53 110.807 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.47 21.12 2.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.196 -0.456 . . . . 74.13 110.877 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -112.0 -61.79 1.66 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 54.2 110.863 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.526 ' HG3' ' HE3' ' A' ' 11' ' ' MET . 11.5 tp10 -77.34 61.67 2.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 65.02 110.874 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.0 p -95.24 154.28 17.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 74.12 110.859 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.74 ' HB ' HD12 ' A' ' 35' ' ' LEU . 19.0 mm -140.89 139.84 33.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 74.12 111.136 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.6 mtt -142.15 143.84 33.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 73.23 110.909 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.1 m-20 -92.51 -169.67 2.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.236 -0.438 . . . . 64.13 110.893 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -60.92 2.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 53.33 110.902 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.91 -57.58 8.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.262 -0.427 . . . . 74.32 110.857 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.72 -58.01 6.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 70.33 110.865 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.8 t -53.65 -42.64 68.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 71.31 110.809 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.2 -44.14 83.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.164 -0.471 . . . . 72.14 110.856 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.14 -62.08 1.75 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 63.45 111.093 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.463 ' O ' HG13 ' A' ' 57' ' ' VAL . 20.8 t80 -52.05 -46.21 65.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 75.51 110.834 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.42 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.94 -51.33 64.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 72.25 110.905 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -50.51 -40.24 50.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.444 . . . . 62.54 111.099 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.742 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.5 mt-30 -72.07 -67.85 0.51 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 50.13 110.902 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.463 HG13 ' O ' ' A' ' 53' ' ' PHE . 15.2 m -46.47 -36.87 3.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.448 . . . . 74.13 111.135 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.62 -50.73 33.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 73.22 110.908 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.11 -50.99 60.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 72.22 111.066 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.637 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -66.53 -46.16 77.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 72.14 110.874 -179.888 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.48 -51.51 35.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.133 -0.485 . . . . 72.02 110.872 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.37 -54.68 25.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 75.13 111.095 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.08 -40.53 32.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.243 -0.435 . . . . 54.3 110.86 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.637 HG23 ' O ' ' A' ' 60' ' ' PHE . 42.4 t -79.68 -27.4 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.132 -0.485 . . . . 72.4 111.15 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.93 -19.41 60.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 74.22 110.905 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.74 -22.07 63.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 75.05 111.099 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -60.09 -175.27 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 75.41 110.931 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 1.029 HG22 HG13 ' A' ' 69' ' ' VAL . 86.4 m -57.36 -77.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.172 -0.467 . . . . 74.54 111.125 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 1.029 HG13 HG22 ' A' ' 68' ' ' THR . 4.6 m -139.35 -175.7 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 73.32 111.1 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.535 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.02 159.41 29.74 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.587 0.708 . . . . 43.12 111.079 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.683 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.3 Cg_endo -69.8 -7.54 21.34 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.682 2.255 . . . . 72.52 112.292 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -92.19 -39.5 11.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 71.53 110.876 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -57.34 -61.17 2.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 71.33 110.88 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.683 HD11 ' HA ' ' A' ' 71' ' ' PRO . 0.3 OUTLIER -44.74 -68.11 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 74.21 111.136 179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.1 m -48.85 -39.09 11.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 71.12 111.144 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.6 mtmt -60.4 -39.41 87.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.204 -0.453 . . . . 74.41 110.9 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.458 ' HB ' HD22 ' A' ' 117' ' ' LEU . 99.6 t -70.35 -37.97 72.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 74.5 111.167 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.66 -33.33 72.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 54.24 110.859 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.1 pttt -89.53 -19.25 25.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 74.11 110.886 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 21.8 ttmt -75.97 -51.19 12.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 71.23 110.87 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.851 HD13 HD12 ' A' ' 120' ' ' LEU . 8.3 mt -92.09 14.66 15.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.205 -0.452 . . . . 64.35 110.915 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.32 41.13 27.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 54.04 110.881 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.842 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.5 mm? -79.04 86.46 4.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.138 -0.483 . . . . 70.21 110.872 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.668 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -45.83 156.05 0.15 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 63.52 111.157 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.23 -19.41 54.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 75.24 110.883 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -53.21 6.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 73.01 110.917 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.668 ' H ' HG23 ' A' ' 84' ' ' THR . 1.2 tt0 -62.63 -49.34 75.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.234 -0.439 . . . . 64.1 110.946 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.443 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -55.57 -31.64 62.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 73.15 111.153 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 24.5 p -80.02 -35.79 36.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 62.4 110.885 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -74.81 -22.82 58.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.09 -0.504 . . . . 63.23 110.904 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.704 ' CD1' HD12 ' A' ' 127' ' ' LEU . 52.8 mt -103.71 -62.87 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 61.13 111.142 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.552 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.8 m-85 -75.64 -63.95 1.18 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 75.43 110.902 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 124.69 34.36 0.7 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.731 -0.747 . . . . 44.31 112.475 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -52.01 -50.14 46.2 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.743 -0.741 . . . . 41.52 112.51 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.95 -137.11 13.88 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.739 -0.743 . . . . 71.53 112.526 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.14 -73.36 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.781 0.324 . . . . 62.22 111.147 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -85.25 40.94 0.85 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 71.14 110.89 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -60.35 -75.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 55.14 111.053 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.417 ' C ' ' O ' ' A' ' 98' ' ' ALA . 25.4 m-85 -36.38 -47.03 0.58 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 75.24 110.849 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.1 m -57.38 -76.08 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.481 . . . . 74.31 110.899 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.531 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 8.0 mtt180 -47.39 -52.8 15.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.08 -0.509 . . . . 64.23 110.859 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.568 ' HB3' HD12 ' A' ' 74' ' ' ILE . 10.6 m-85 -49.67 -38.26 31.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 64.35 110.923 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -54.33 -38.85 66.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.13 -0.486 . . . . 74.53 110.894 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.22 -17.32 22.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.139 -0.482 . . . . 61.22 110.916 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.28 26.19 16.7 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.751 -0.738 . . . . 73.05 112.47 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 74.7 m-80 -94.3 -24.65 17.34 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.863 0.363 . . . . 71.23 110.925 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.531 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -105.05 18.7 21.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 22.02 111.085 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.495 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.6 tm0? -120.39 55.98 4.39 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.637 0.732 . . . . 71.14 110.941 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.4 Cg_endo -69.77 28.67 0.18 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.664 2.243 . . . . 64.45 112.334 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.694 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.9 OUTLIER 69.42 38.37 0.17 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.547 0.689 . . . . 74.34 110.842 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.694 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.5 Cg_endo -69.7 -165.49 0.15 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.689 2.259 . . . . 74.13 112.369 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 14.1 m -81.46 -34.41 31.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 63.14 110.845 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.552 HG23 ' HB3' ' A' ' 92' ' ' PHE . 14.8 m -48.78 -42.34 35.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 73.42 111.192 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.421 HD11 ' HG2' ' A' ' 108' ' ' GLN . 27.7 mm -60.26 -44.0 94.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 62.53 111.133 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.658 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -64.18 -29.34 70.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.169 -0.469 . . . . 73.22 110.864 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.658 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.6 mp -81.24 -42.83 20.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.244 -0.435 . . . . 74.04 110.881 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.638 HD13 HG22 ' A' ' 74' ' ' ILE . 36.1 mt -61.09 -49.45 77.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 65.23 110.925 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.561 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.7 ptp180 -51.92 -39.76 59.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 60.54 110.914 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.561 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.8 m -88.13 -13.01 10.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 73.22 111.092 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.851 HD12 HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -79.06 -41.35 29.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 72.21 110.874 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -48.79 -32.82 9.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 72.41 110.876 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.2 -21.39 17.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 73.22 110.941 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.74 ' O ' HD13 ' A' ' 120' ' ' LEU . 42.1 m-70 -126.52 87.66 55.94 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.552 0.691 . . . . 61.53 110.863 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.658 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.5 Cg_endo -69.71 3.37 2.78 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.692 2.261 . . . . 63.34 112.392 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -117.22 -12.45 10.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.177 -0.465 . . . . 74.54 110.898 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.663 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.2 tp -54.06 -46.57 72.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.168 -0.469 . . . . 71.22 110.932 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.704 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.73 -29.42 7.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 64.0 110.891 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.492 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.59 -27.55 23.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 73.41 110.885 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.43 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -94.68 5.03 53.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 71.44 110.859 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 126' ' ' LEU . 11.6 pt -124.29 -35.12 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.471 . . . . 75.14 111.117 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.492 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.2 ptt-85 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.178 -0.465 . . . . 65.42 110.893 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.51 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.895 0.379 . . . . 71.03 110.917 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.83 -169.04 0.39 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 75.44 110.893 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.8 p 176.73 59.86 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.382 0 CA-C-O 121.576 0.703 . . . . 43.34 110.883 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.84 4.8 2.02 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.646 2.231 . . . . 71.42 112.297 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.2 m -104.01 -45.79 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.436 . . . . 73.21 111.141 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.4 m -107.77 -34.15 7.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 61.32 110.885 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 61.03 46.45 8.3 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.089 -0.505 . . . . 72.33 110.896 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -109.35 -74.21 0.66 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.166 -0.47 . . . . 75.22 110.943 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.541 ' HA3' HG23 ' A' ' 38' ' ' VAL . . . -107.95 -106.9 3.12 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.695 -0.764 . . . . 52.11 112.535 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.51 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 5.5 pt-20 -176.56 96.37 0.05 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.89 0.376 . . . . 70.42 110.889 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.595 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.8 ptp -52.58 104.76 0.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.168 -0.469 . . . . 75.52 110.92 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.497 HG12 ' O ' ' A' ' 10' ' ' GLU . 4.2 p -143.02 126.1 13.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.254 -0.43 . . . . 64.13 111.151 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.595 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -49.77 128.37 17.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.124 -0.489 . . . . 73.31 110.861 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.416 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.26 84.28 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.778 -0.725 . . . . 74.04 112.532 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.416 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.67 145.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.872 0.368 . . . . 74.44 111.146 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.53 -167.28 2.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 73.34 110.856 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.692 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -93.44 118.15 30.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 75.12 110.86 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.736 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.3 mm -109.28 91.17 9.28 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.667 0.746 . . . . 71.03 111.161 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.473 ' HA ' HG22 ' A' ' 28' ' ' VAL . 54.3 Cg_endo -69.67 95.81 0.56 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.745 2.297 . . . . 61.1 112.404 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -63.43 -37.27 86.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 63.41 110.901 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.485 HG21 ' HG2' ' A' ' 25' ' ' ARG . 19.2 m -131.21 149.67 52.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.091 -0.504 . . . . 61.12 111.205 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -148.51 44.22 1.02 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.27 -0.423 . . . . 73.4 110.926 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.29 -46.14 0.77 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.117 -0.492 . . . . 71.45 110.84 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -149.08 -50.46 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.67 -0.776 . . . . 64.21 112.469 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.485 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -101.7 47.1 0.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.912 0.387 . . . . 74.32 110.876 -179.827 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.428 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 14.8 tttt -55.33 121.62 9.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 73.32 110.9 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.416 ' O ' HG23 ' A' ' 27' ' ' THR . 1.8 t -138.52 93.83 2.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 73.42 111.134 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.692 HG11 ' HB2' ' A' ' 17' ' ' ASP . 44.2 t -77.55 128.14 38.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 73.31 111.104 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.745 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.2 OUTLIER -84.51 51.92 2.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 62.31 110.955 179.906 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 29' ' ' LEU . 29.0 mttp -37.4 107.7 0.07 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 71.22 110.859 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.27 50.05 0.39 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.713 -0.756 . . . . 72.21 112.478 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.6 HD11 ' HB3' ' A' ' 29' ' ' LEU . 19.0 mm -109.36 93.04 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.787 0.327 . . . . 61.5 111.166 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.27 150.7 38.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 61.35 110.822 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.9 -106.12 0.25 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.805 -0.712 . . . . 52.54 112.501 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.774 HD12 ' HB ' ' A' ' 44' ' ' ILE . 43.5 mt -156.65 84.82 0.97 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.875 0.369 . . . . 71.4 110.873 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.497 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -158.74 162.51 37.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 74.14 110.916 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.2 t -171.28 -37.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.094 -0.503 . . . . 73.4 110.904 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.541 HG23 ' HA3' ' A' ' 9' ' ' GLY . 0.3 OUTLIER -128.13 -40.56 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 53.44 111.141 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -97.05 170.89 8.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.129 -0.487 . . . . 71.53 110.835 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.25 12.96 2.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.216 -0.447 . . . . 74.13 110.866 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -103.07 -65.2 1.01 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 54.2 110.872 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -76.98 61.46 1.97 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.193 -0.458 . . . . 65.02 110.886 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.5 m -102.06 160.6 14.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 74.12 110.814 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.774 ' HB ' HD12 ' A' ' 35' ' ' LEU . 15.3 mm -141.14 140.79 31.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.118 -0.492 . . . . 74.12 111.135 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 16.2 mtm -143.8 132.45 22.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.087 -0.506 . . . . 73.23 110.889 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 35.8 m-20 -82.65 -169.72 2.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 64.13 110.871 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -61.44 2.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 53.33 110.87 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -51.63 -57.47 9.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.406 . . . . 74.32 110.872 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -50.54 -57.08 8.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 70.33 110.94 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.0 t -55.08 -40.06 69.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.495 . . . . 71.31 110.871 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.44 -45.62 88.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.129 -0.487 . . . . 72.14 110.877 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.22 -59.98 3.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 63.45 111.096 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.432 ' O ' HG13 ' A' ' 57' ' ' VAL . 14.8 t80 -53.32 -48.51 68.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.267 -0.424 . . . . 75.51 110.832 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.423 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.28 -48.48 79.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 72.25 110.886 179.956 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.2 -41.51 62.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 62.54 111.137 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.745 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.7 mt-30 -70.28 -66.67 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 50.13 110.854 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.458 HG12 HD21 ' A' ' 29' ' ' LEU . 12.0 m -47.5 -35.79 4.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.275 -0.42 . . . . 74.13 111.148 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -69.43 -54.48 14.17 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.188 -0.46 . . . . 73.22 110.858 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.16 -52.25 27.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 72.22 111.116 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.629 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -63.32 -48.61 77.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.204 -0.453 . . . . 72.14 110.88 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.8 -36.49 37.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 72.02 110.856 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.58 -53.75 9.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.462 . . . . 75.13 111.116 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.34 -25.73 64.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.233 -0.44 . . . . 54.3 110.84 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.629 HG22 ' O ' ' A' ' 60' ' ' PHE . 16.3 m -97.48 -16.24 7.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.467 . . . . 72.4 111.092 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.79 -22.95 27.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.23 -0.441 . . . . 74.22 110.899 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -50.81 -30.22 13.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 75.05 111.143 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -113.15 139.65 48.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.278 -0.419 . . . . 75.41 110.883 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 1.016 HG22 HG13 ' A' ' 69' ' ' VAL . 97.3 m -66.04 -75.39 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.145 -0.479 . . . . 74.54 111.155 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 1.016 HG13 HG22 ' A' ' 68' ' ' THR . 10.8 m -131.95 -172.22 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.252 -0.431 . . . . 73.32 111.169 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.537 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -105.24 159.44 29.4 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.559 0.695 . . . . 43.12 111.105 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.644 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.2 Cg_endo -69.79 -7.37 20.9 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.686 2.258 . . . . 72.52 112.369 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -92.26 -38.72 11.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.434 . . . . 71.53 110.832 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -57.58 -61.36 2.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 71.33 110.898 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.804 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -45.15 -67.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 74.21 111.183 179.933 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.8 m -48.88 -39.33 11.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 71.12 111.098 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 23.1 mtmt -61.14 -45.04 96.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 74.41 110.864 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.596 HG22 ' HB2' ' A' ' 121' ' ' ASP . 75.8 t -61.81 -39.05 82.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.234 -0.439 . . . . 74.5 111.118 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.451 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -64.37 -58.71 5.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 54.24 110.924 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -24.91 67.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 74.11 110.937 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 18.5 ttmt -68.23 -52.02 38.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.184 -0.462 . . . . 71.23 110.898 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.847 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.5 mt -91.82 12.53 21.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 64.35 110.898 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.1 t 53.74 37.48 26.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 54.04 110.898 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.847 HD23 ' HB2' ' A' ' 81' ' ' LEU . 2.0 mm? -79.69 87.31 5.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 70.21 110.922 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.644 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.73 156.38 0.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 63.52 111.129 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.14 -21.15 58.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 75.24 110.899 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -50.13 10.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.254 -0.43 . . . . 73.01 110.873 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.644 ' H ' HG23 ' A' ' 84' ' ' THR . 0.9 OUTLIER -64.95 -53.0 53.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 64.1 110.84 179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -52.19 -33.66 41.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.135 -0.484 . . . . 73.15 111.072 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 23.1 t -79.56 -36.61 38.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 62.4 110.837 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -72.95 -24.38 60.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.112 -0.495 . . . . 63.23 110.939 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.713 ' CD1' HD12 ' A' ' 127' ' ' LEU . 51.4 mt -101.81 -63.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 61.13 111.095 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.582 ' HB3' HG23 ' A' ' 113' ' ' THR . 8.3 m-85 -74.34 -60.68 2.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 75.43 110.826 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 110.26 49.37 0.72 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.701 -0.762 . . . . 44.31 112.438 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.88 -36.91 31.03 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.764 -0.731 . . . . 41.52 112.501 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.412 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 102.82 165.08 26.03 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.771 -0.728 . . . . 71.53 112.522 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.49 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.8 p -50.93 -50.89 22.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.89 0.376 . . . . 62.22 111.12 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.49 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.7 OUTLIER -86.87 38.46 0.8 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.487 . . . . 71.14 110.89 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.412 ' HB2' ' O ' ' A' ' 95' ' ' GLY . . . -63.85 -76.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 55.14 111.097 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -43.02 -40.37 3.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 75.24 110.877 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.1 m -59.98 -75.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.145 -0.479 . . . . 74.31 110.857 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.63 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 32.5 mtt180 -50.03 -45.72 52.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.094 -0.503 . . . . 64.23 110.873 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.72 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.0 m-85 -55.41 -37.31 67.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.24 -0.436 . . . . 64.35 110.852 -179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -51.3 -30.11 17.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 74.53 110.928 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -106.96 -22.11 12.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.478 . . . . 61.22 110.889 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.69 26.75 9.57 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.784 -0.722 . . . . 73.05 112.539 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -98.06 -4.7 35.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.822 0.344 . . . . 71.23 110.83 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.63 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -112.11 8.7 20.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 22.02 111.041 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.558 ' HB2' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -124.73 57.44 15.09 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.563 0.697 . . . . 71.14 110.855 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.53 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.9 Cg_endo -69.78 36.32 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.646 2.231 . . . . 64.45 112.342 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.772 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.5 t-160 73.93 32.28 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.522 0.677 . . . . 74.34 110.846 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.772 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 52.8 Cg_endo -69.86 -163.84 0.12 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.638 2.225 . . . . 74.13 112.316 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.44 -30.26 23.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.251 -0.432 . . . . 63.14 110.845 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.582 HG23 ' HB3' ' A' ' 92' ' ' PHE . 21.1 m -53.34 -50.57 64.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.138 -0.483 . . . . 73.42 111.141 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.558 HD11 ' HB2' ' A' ' 108' ' ' GLN . 41.0 mm -51.31 -42.36 26.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 62.53 111.136 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.555 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -68.17 -29.63 68.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.166 -0.47 . . . . 73.22 110.914 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.555 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.7 mp -79.25 -42.1 26.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 74.04 110.941 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.804 HD13 HG22 ' A' ' 74' ' ' ILE . 17.0 mt -63.93 -48.93 74.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 65.23 110.909 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.597 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.9 ptp180 -52.2 -34.81 47.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 60.54 110.882 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.597 HG13 ' HG3' ' A' ' 118' ' ' ARG . 30.9 m -93.88 -13.91 8.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.475 . . . . 73.22 111.144 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.82 HD12 HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -77.14 -40.29 46.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 72.21 110.9 179.954 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.596 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.5 OUTLIER -50.0 -31.23 12.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.187 -0.461 . . . . 72.41 110.822 179.88 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.35 -20.86 18.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 73.22 110.868 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.741 ' O ' HD13 ' A' ' 120' ' ' LEU . 53.7 m-70 -128.55 88.59 51.87 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.565 0.698 . . . . 61.53 110.835 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.704 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.9 Cg_endo -69.71 3.4 2.76 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.646 2.231 . . . . 63.34 112.367 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -117.83 -11.98 10.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.43 . . . . 74.54 110.912 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.527 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.5 tp -53.54 -47.99 69.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.199 -0.455 . . . . 71.22 110.976 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.713 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.9 pt? -46.32 -32.77 3.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.467 . . . . 64.0 110.871 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -81.87 -38.1 25.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.17 -0.468 . . . . 73.41 110.907 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.578 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -78.74 -6.18 55.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.458 . . . . 71.44 110.89 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.578 HG23 ' HG3' ' A' ' 129' ' ' GLU . 7.9 pt -119.17 -20.41 4.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 75.14 111.119 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.427 ' HG2' HG23 ' A' ' 91' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 65.42 110.892 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mtt . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.885 0.374 . . . . 71.03 110.88 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.02 -169.43 0.4 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 75.44 110.947 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.7 t -178.91 60.12 0.12 Allowed Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.588 0.709 . . . . 43.34 110.876 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -0.1 6.46 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 122.715 2.277 . . . . 71.42 112.324 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.628 HG21 ' OE1' ' A' ' 42' ' ' GLU . 27.8 m -87.52 -43.96 15.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.268 -0.424 . . . . 73.21 111.153 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.457 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -127.17 -30.8 2.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.474 . . . . 61.32 110.913 179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 22.1 m-70 69.79 68.91 0.23 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 72.33 110.897 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -132.52 -71.72 0.53 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 75.22 110.994 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.34 -129.99 6.84 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.71 -0.757 . . . . 52.11 112.482 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.459 ' O ' HG12 ' A' ' 12' ' ' VAL . 9.6 pt-20 -161.2 87.89 0.73 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.799 0.333 . . . . 70.42 110.88 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.561 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -50.64 105.04 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.146 -0.479 . . . . 75.52 110.874 179.951 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 10' ' ' GLU . 5.0 p -142.58 126.93 15.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 64.13 111.132 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.589 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.4 OUTLIER -49.51 129.28 18.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 73.31 110.791 -179.815 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.406 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 179.98 81.46 0.06 OUTLIER Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.72 -0.753 . . . . 74.04 112.46 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.414 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.02 146.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.912 0.386 . . . . 74.44 111.088 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.91 -165.4 1.62 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.12 -0.491 . . . . 73.34 110.854 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.654 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.6 OUTLIER -95.48 117.15 29.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 75.12 110.792 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.734 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.0 mm -107.88 91.53 7.77 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.623 0.725 . . . . 71.03 111.203 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.408 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.7 Cg_endo -69.72 96.48 0.59 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.678 2.252 . . . . 61.1 112.343 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.514 ' HB3' HG23 ' A' ' 27' ' ' THR . 16.6 t80 -61.15 -40.04 92.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 63.41 110.944 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.479 HG21 ' HG2' ' A' ' 25' ' ' ARG . 15.7 m -126.72 145.18 50.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.126 -0.488 . . . . 61.12 111.17 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -134.02 45.54 2.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 73.4 110.857 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.45 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -132.09 -68.4 0.63 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 71.45 110.911 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -136.08 -46.35 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.704 -0.76 . . . . 64.21 112.475 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.479 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.38 39.84 1.09 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.912 0.387 . . . . 74.32 110.918 -179.853 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -52.67 115.23 1.7 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.079 -0.51 . . . . 73.32 110.907 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.514 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -127.76 93.81 3.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 73.42 111.118 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.654 HG11 ' HB2' ' A' ' 17' ' ' ASP . 43.7 t -77.69 126.42 38.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 73.31 111.133 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.74 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.61 51.42 2.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 62.31 110.923 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.402 ' C ' ' O ' ' A' ' 29' ' ' LEU . 23.1 mttp -38.06 108.03 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 71.22 110.866 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.86 46.66 0.42 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.681 -0.771 . . . . 72.21 112.46 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.576 HD11 ' HB3' ' A' ' 29' ' ' LEU . 14.9 mm -107.61 91.22 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.838 0.352 . . . . 61.5 111.104 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.01 154.29 39.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.209 -0.451 . . . . 61.35 110.827 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.99 -108.57 0.31 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.709 -0.757 . . . . 52.54 112.491 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.757 HD12 ' HB ' ' A' ' 44' ' ' ILE . 49.9 mt -157.11 86.12 0.96 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.847 0.356 . . . . 71.4 110.874 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.402 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.02 161.08 33.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.151 -0.477 . . . . 74.14 110.905 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.6 t -169.58 -38.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.109 -0.496 . . . . 73.4 110.853 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.6 m -125.79 -47.18 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 53.44 111.153 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.88 170.43 10.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 71.53 110.892 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.9 t -137.4 15.91 2.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 74.13 110.863 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -104.82 -62.99 1.26 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 54.2 110.876 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.628 ' OE1' HG21 ' A' ' 5' ' ' VAL . 7.8 tp10 -77.15 61.93 2.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 65.02 110.897 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.6 p -97.09 154.21 17.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.088 -0.505 . . . . 74.12 110.891 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.757 ' HB ' HD12 ' A' ' 35' ' ' LEU . 20.1 mm -141.25 139.77 32.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 74.12 111.158 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.8 mtt -142.88 139.68 30.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.425 . . . . 73.23 110.852 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 41.1 m-20 -87.59 -169.94 2.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 64.13 110.885 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.83 -61.03 2.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.191 -0.459 . . . . 53.33 110.843 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.48 -57.44 9.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 74.32 110.979 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.02 -58.15 6.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.031 -0.531 . . . . 70.33 110.84 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.5 t -53.49 -42.38 67.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 71.31 110.926 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.59 -44.0 85.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.093 -0.503 . . . . 72.14 110.936 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.77 -61.82 1.95 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 63.45 111.106 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.501 ' O ' HG13 ' A' ' 57' ' ' VAL . 18.1 t80 -52.6 -46.7 67.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.455 . . . . 75.51 110.859 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.44 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.41 -49.03 75.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.499 . . . . 72.25 110.91 179.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.94 -42.66 63.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.474 . . . . 62.54 111.135 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.74 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.6 mt-30 -69.65 -66.54 0.57 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 50.13 110.884 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.501 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.3 m -47.24 -35.72 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 74.13 111.143 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.7 mmmt -69.07 -54.89 12.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 73.22 110.883 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.07 -53.58 19.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.246 -0.434 . . . . 72.22 111.063 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.701 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -62.88 -49.27 75.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.45 . . . . 72.14 110.868 -179.889 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.74 -36.31 25.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 72.02 110.823 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.65 -54.04 9.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.265 -0.425 . . . . 75.13 111.158 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.21 -28.27 64.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 54.3 110.884 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.701 HG22 ' O ' ' A' ' 60' ' ' PHE . 23.2 m -94.9 -17.29 7.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.095 -0.502 . . . . 72.4 111.166 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.67 -30.3 55.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 74.22 110.862 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.75 -18.9 57.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 75.05 111.106 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -67.07 -18.42 65.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.45 . . . . 75.41 110.893 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.924 HG22 HG13 ' A' ' 69' ' ' VAL . 62.2 m -49.1 -69.23 0.12 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 74.54 111.089 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.924 HG13 HG22 ' A' ' 68' ' ' THR . 7.1 m -138.48 -173.12 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 73.32 111.144 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.546 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.8 159.95 28.06 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.617 0.722 . . . . 43.12 111.104 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.574 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.4 Cg_endo -69.86 -7.48 21.2 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.658 2.239 . . . . 72.52 112.312 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -93.92 -37.44 11.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 71.53 110.856 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -57.76 -61.58 2.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.188 -0.46 . . . . 71.33 110.896 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.792 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.92 -67.33 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.154 -0.476 . . . . 74.21 111.106 -179.984 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -48.88 -39.49 11.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 71.12 111.09 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 22.5 mtmt -60.6 -46.17 91.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.459 . . . . 74.41 110.873 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.611 HG22 ' HB2' ' A' ' 121' ' ' ASP . 73.4 t -60.92 -39.3 81.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 74.5 111.094 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.441 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -63.91 -60.73 2.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.181 -0.463 . . . . 54.24 110.848 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -22.91 66.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 74.11 110.832 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -68.94 -54.04 17.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 71.23 110.884 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.701 HD22 ' HB3' ' A' ' 124' ' ' PRO . 9.2 mt -91.52 14.69 14.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.24 -0.436 . . . . 64.35 110.909 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 11.0 m 53.19 39.47 29.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 54.04 110.838 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.694 HD22 ' CE2' ' A' ' 92' ' ' PHE . 0.4 OUTLIER -79.69 88.17 5.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 70.21 110.958 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.676 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -46.73 156.87 0.17 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 63.52 111.197 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -59.67 -19.79 51.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 75.24 110.916 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 33.2 mmtt -82.45 -52.45 6.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.194 -0.457 . . . . 73.01 110.873 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.676 ' H ' HG23 ' A' ' 84' ' ' THR . 2.8 tt0 -61.75 -51.78 66.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 64.1 110.844 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.44 -34.2 56.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 73.15 111.101 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.4 t -80.14 -31.1 39.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.245 -0.434 . . . . 62.4 110.906 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -77.84 -25.64 48.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.097 -0.502 . . . . 63.23 110.838 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.701 ' CD1' HD12 ' A' ' 127' ' ' LEU . 47.7 mt -101.23 -59.73 3.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 61.13 111.121 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.694 ' CE2' HD22 ' A' ' 83' ' ' LEU . 7.7 m-85 -77.3 -61.12 2.09 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 75.43 110.898 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.78 50.07 0.71 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.767 -0.73 . . . . 44.31 112.486 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -78.77 -38.62 23.25 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 41.52 112.474 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.407 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 104.79 166.41 24.28 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.738 -0.744 . . . . 71.53 112.471 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.496 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.9 p -51.76 -50.66 31.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.892 0.377 . . . . 62.22 111.101 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.496 ' N ' HG13 ' A' ' 96' ' ' VAL . 81.4 m-20 -86.91 38.65 0.81 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 71.14 110.917 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 95' ' ' GLY . . . -64.19 -76.46 0.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 55.14 111.08 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -43.33 -40.45 3.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.218 -0.446 . . . . 75.24 110.891 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.8 m -60.09 -75.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 74.31 110.874 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.626 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 30.9 mtt180 -49.84 -45.82 50.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.183 -0.462 . . . . 64.23 110.918 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.724 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.3 m-85 -55.65 -37.28 68.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.197 -0.456 . . . . 64.35 110.904 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -51.83 -29.69 20.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.493 . . . . 74.53 110.856 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.8 -22.29 12.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 61.22 110.94 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.65 26.9 9.45 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.782 -0.723 . . . . 73.05 112.504 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -98.19 -5.85 32.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.857 0.361 . . . . 71.23 110.889 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.626 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -110.83 9.22 22.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.136 -0.484 . . . . 22.02 111.07 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.551 ' HB2' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -125.07 57.35 15.83 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.604 0.716 . . . . 71.14 110.835 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.532 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.0 Cg_endo -69.8 36.08 0.23 Allowed 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.656 2.238 . . . . 64.45 112.394 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.777 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 1.7 t-80 74.1 31.99 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.547 0.689 . . . . 74.34 110.849 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.777 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.6 Cg_endo -69.74 -163.83 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.71 2.273 . . . . 74.13 112.324 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 20.2 m -85.67 -29.58 23.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.445 . . . . 63.14 110.884 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.581 HG23 ' HB3' ' A' ' 92' ' ' PHE . 22.0 m -53.7 -50.84 65.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.113 -0.494 . . . . 73.42 111.14 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.551 HD11 ' HB2' ' A' ' 108' ' ' GLN . 39.3 mm -51.06 -42.61 24.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.249 -0.432 . . . . 62.53 111.094 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.534 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -68.08 -29.84 68.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 73.22 110.89 179.879 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.534 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.5 mp -78.82 -42.2 28.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.242 -0.435 . . . . 74.04 110.912 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.792 HD13 HG22 ' A' ' 74' ' ' ILE . 16.3 mt -64.06 -48.8 74.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 65.23 110.954 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.593 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.0 ptp180 -52.77 -34.63 54.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 60.54 110.918 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.593 HG13 ' HG3' ' A' ' 118' ' ' ARG . 29.3 m -93.66 -13.95 8.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 73.22 111.114 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.756 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -77.62 -40.2 42.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.111 -0.495 . . . . 72.21 110.899 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.611 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.5 OUTLIER -50.03 -31.1 12.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 72.41 110.852 179.932 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.51 -20.63 18.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.134 -0.485 . . . . 73.22 110.929 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.756 ' O ' HD13 ' A' ' 120' ' ' LEU . 50.3 m-70 -129.01 89.56 48.29 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.643 0.735 . . . . 61.53 110.854 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.701 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.2 Cg_endo -69.72 1.05 4.76 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.703 2.269 . . . . 63.34 112.334 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -114.53 -12.51 12.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 74.54 110.932 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.687 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.8 tp -53.85 -47.76 70.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.082 -0.508 . . . . 71.22 110.979 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.701 HD12 ' CD1' ' A' ' 91' ' ' ILE . 2.6 pt? -50.5 -29.21 9.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 64.0 110.955 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.474 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.59 -26.68 24.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.183 -0.462 . . . . 73.41 110.873 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.419 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.9 OUTLIER -95.52 4.1 53.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.446 . . . . 71.44 110.917 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.687 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.3 pt -123.16 -34.7 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 75.14 111.121 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.474 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 2.8 ptt-85 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 65.42 110.902 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 mmt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.864 0.364 . . . . 71.03 110.85 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.67 -168.81 0.39 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.272 -0.422 . . . . 75.44 110.877 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 p -179.45 61.18 0.12 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.579 0.704 . . . . 43.34 110.847 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.73 -5.41 16.12 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.706 2.271 . . . . 71.42 112.319 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.571 HG12 ' N ' ' A' ' 6' ' ' CYS . 1.7 t -72.0 -60.52 2.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 73.21 111.132 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.571 ' N ' HG12 ' A' ' 5' ' ' VAL . 0.5 OUTLIER -124.23 -17.91 6.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 61.32 110.906 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 63.85 72.57 0.46 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 72.33 110.87 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -131.29 -75.55 0.52 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.146 -0.479 . . . . 75.22 110.934 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -94.3 -117.22 2.85 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.727 -0.749 . . . . 52.11 112.515 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.438 ' HG2' HG22 ' A' ' 38' ' ' VAL . 7.0 pt-20 -170.84 93.94 0.19 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.86 0.362 . . . . 70.42 110.891 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.542 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -59.23 103.06 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.466 . . . . 75.52 110.852 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.7 p -144.28 129.32 14.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.282 -0.417 . . . . 64.13 111.169 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.603 ' N ' HD23 ' A' ' 35' ' ' LEU . 9.9 p -48.31 131.8 16.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.147 -0.479 . . . . 73.31 110.813 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.42 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.98 79.72 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.748 -0.739 . . . . 74.04 112.46 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.42 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.0 144.85 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.913 0.387 . . . . 74.44 111.115 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.08 -165.61 1.76 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.475 . . . . 73.34 110.889 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.69 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -94.62 116.91 29.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 75.12 110.911 179.867 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.745 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.9 mm -108.83 90.76 7.99 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.652 0.739 . . . . 71.03 111.134 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.525 ' HA ' HG22 ' A' ' 28' ' ' VAL . 54.3 Cg_endo -69.7 96.93 0.61 Allowed 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.72 2.28 . . . . 61.1 112.332 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -64.98 -36.41 84.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.294 -0.412 . . . . 63.41 110.861 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.55 HG21 ' HG2' ' A' ' 25' ' ' ARG . 58.7 m -128.2 151.64 49.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 61.12 111.162 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -152.27 41.69 0.64 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.438 . . . . 73.4 110.908 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.56 -39.61 1.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.132 -0.485 . . . . 71.45 110.887 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -158.53 -45.14 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.76 -0.734 . . . . 64.21 112.545 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.55 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -105.71 44.8 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.892 0.377 . . . . 74.32 110.915 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.484 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 0.5 OUTLIER -51.75 118.66 3.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 73.32 110.908 179.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.416 ' O ' HG23 ' A' ' 27' ' ' THR . 1.8 t -132.91 92.36 3.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.233 -0.439 . . . . 73.42 111.12 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.69 HG11 ' HB2' ' A' ' 17' ' ' ASP . 59.1 t -76.84 128.95 37.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 73.31 111.062 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.75 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.44 52.14 2.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 62.31 110.951 179.937 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.407 ' C ' ' O ' ' A' ' 29' ' ' LEU . 32.4 mttp -36.89 107.38 0.06 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 71.22 110.908 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.05 50.15 0.4 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.715 -0.755 . . . . 72.21 112.55 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.61 HD11 ' CB ' ' A' ' 29' ' ' LEU . 20.3 mm -108.89 93.14 2.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.836 0.351 . . . . 61.5 111.152 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -76.24 152.92 36.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.464 . . . . 61.35 110.817 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.96 -108.47 0.31 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.717 -0.754 . . . . 52.54 112.479 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.756 HD12 ' HB ' ' A' ' 44' ' ' ILE . 56.0 mt -156.92 85.98 0.97 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.816 0.341 . . . . 71.4 110.956 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.468 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.23 160.57 32.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 74.14 110.926 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.3 t -162.78 -41.0 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 73.4 110.885 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.438 HG22 ' HG2' ' A' ' 10' ' ' GLU . 4.3 m -127.99 -47.38 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.212 -0.449 . . . . 53.44 111.149 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.403 ' N ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -85.9 170.0 12.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.134 -0.484 . . . . 71.53 110.883 179.926 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -136.43 8.47 3.13 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.241 -0.436 . . . . 74.13 110.928 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -97.84 -63.45 1.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 54.2 110.896 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.442 ' OE1' HG11 ' A' ' 5' ' ' VAL . 6.1 tp10 -77.03 60.96 1.91 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 65.02 110.922 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.2 p -99.65 161.98 13.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 74.12 110.816 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.756 ' HB ' HD12 ' A' ' 35' ' ' LEU . 23.2 mm -144.22 140.21 24.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.091 -0.504 . . . . 74.12 111.055 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.6 mtm -144.89 129.98 18.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.138 -0.483 . . . . 73.23 110.92 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.7 m-20 -83.38 -169.79 2.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 64.13 110.877 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.62 -57.8 10.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 53.33 110.877 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -56.16 22.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.439 . . . . 74.32 110.905 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.64 -60.1 3.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.12 -0.491 . . . . 70.33 110.973 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.3 t -54.2 -39.38 66.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 71.31 110.834 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.44 -45.88 87.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.097 -0.501 . . . . 72.14 110.924 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.74 -59.29 4.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 63.45 111.1 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.438 ' O ' HG13 ' A' ' 57' ' ' VAL . 16.8 t80 -53.42 -48.37 68.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.226 -0.443 . . . . 75.51 110.861 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.432 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.93 -48.66 77.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 72.25 110.834 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.16 -41.28 62.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.288 -0.414 . . . . 62.54 111.109 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.75 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.7 mt-30 -70.6 -66.81 0.56 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.175 -0.466 . . . . 50.13 110.893 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.467 HG12 HD21 ' A' ' 29' ' ' LEU . 13.5 m -47.28 -36.38 4.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.247 -0.433 . . . . 74.13 111.078 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -69.35 -52.94 22.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 73.22 110.865 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.56 -49.84 55.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.445 . . . . 72.22 111.122 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -65.86 -49.26 68.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.285 -0.416 . . . . 72.14 110.816 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -48.98 -44.03 40.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 72.02 110.834 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.88 -56.45 7.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 75.13 111.081 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -50.43 -43.3 54.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 54.3 110.882 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.0 p -77.84 -24.48 14.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.113 -0.494 . . . . 72.4 111.143 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -17.51 53.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.179 -0.464 . . . . 74.22 110.893 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.24 -19.6 61.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.116 -0.493 . . . . 75.05 111.151 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -50.98 -75.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.184 -0.462 . . . . 75.41 110.937 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 1.043 HG22 HG13 ' A' ' 69' ' ' VAL . 81.9 m -120.01 -77.99 0.59 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.092 -0.504 . . . . 74.54 111.122 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 1.043 HG13 HG22 ' A' ' 68' ' ' THR . 4.7 m -139.51 -177.82 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.457 . . . . 73.32 111.144 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.54 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -104.56 159.59 28.82 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.598 0.713 . . . . 43.12 111.143 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.733 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.1 Cg_endo -69.77 -6.86 19.61 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.671 2.248 . . . . 72.52 112.385 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.93 -40.99 10.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 71.53 110.884 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -56.71 -61.13 2.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.476 . . . . 71.33 110.885 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.734 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.28 -68.87 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 74.21 111.176 179.943 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.1 m -48.73 -38.7 10.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.456 . . . . 71.12 111.109 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.1 mtmt -60.18 -40.17 89.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 74.41 110.845 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.526 HG22 ' HB2' ' A' ' 121' ' ' ASP . 82.3 t -69.58 -38.18 76.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 74.5 111.174 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -68.27 -35.39 77.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 54.24 110.882 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.0 pttt -88.06 -19.33 27.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.485 . . . . 74.11 110.923 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.431 ' HG2' HD23 ' A' ' 81' ' ' LEU . 0.7 OUTLIER -74.74 -51.73 13.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.446 . . . . 71.23 110.899 179.857 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.812 ' HB2' HD23 ' A' ' 83' ' ' LEU . 7.8 mt -92.21 14.58 15.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.449 . . . . 64.35 110.842 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.3 m 50.58 43.45 27.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 54.04 110.825 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.812 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.3 mm? -78.68 86.21 4.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.129 -0.487 . . . . 70.21 110.909 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.641 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.91 156.04 0.16 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.203 -0.453 . . . . 63.52 111.049 179.98 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -57.73 -22.49 46.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 75.24 110.881 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -79.85 -52.31 8.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 73.01 110.814 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.641 ' H ' HG23 ' A' ' 84' ' ' THR . 5.1 tp10 -62.67 -56.16 20.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.265 -0.425 . . . . 64.1 110.861 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.473 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -52.6 -34.32 50.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 73.15 111.127 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 91.9 p -80.95 -27.71 35.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.2 -0.454 . . . . 62.4 110.849 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -80.52 -26.66 37.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.48 . . . . 63.23 110.938 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.775 HD12 ' HB3' ' A' ' 131' ' ' ARG . 22.4 mm -101.29 -56.46 5.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.133 -0.485 . . . . 61.13 111.119 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.567 ' HB3' HG23 ' A' ' 113' ' ' THR . 4.7 m-85 -80.86 -62.93 1.52 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 75.43 110.933 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 110.95 52.38 0.57 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.692 -0.766 . . . . 44.31 112.469 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -80.71 -40.98 11.43 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.762 -0.733 . . . . 41.52 112.509 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 101.96 -179.87 27.55 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.746 -0.74 . . . . 71.53 112.513 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.528 HG13 ' N ' ' A' ' 97' ' ' ASN . 5.3 p -67.08 -50.55 62.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.822 0.344 . . . . 62.22 111.167 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.528 ' N ' HG13 ' A' ' 96' ' ' VAL . 8.9 p30 -86.24 31.9 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 71.14 110.937 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.63 -75.9 0.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 55.14 111.08 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -39.72 -47.34 2.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 75.24 110.87 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 40.2 t -56.92 -74.78 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 74.31 110.921 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.513 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 36.7 mtt180 -47.07 -54.48 10.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.124 -0.489 . . . . 64.23 110.87 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.616 ' HB3' HD12 ' A' ' 74' ' ' ILE . 13.2 m-85 -49.83 -37.68 31.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.45 . . . . 64.35 110.863 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -55.43 -40.65 71.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 74.53 110.904 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.26 -17.34 26.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 61.22 110.871 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.96 25.7 18.99 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.768 -0.729 . . . . 73.05 112.498 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -93.46 -27.66 16.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.831 0.348 . . . . 71.23 110.816 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.513 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -100.61 18.7 18.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 22.02 111.083 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.494 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.1 tm0? -121.65 53.74 4.23 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.62 0.724 . . . . 71.14 110.889 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 54.0 Cg_endo -69.81 28.51 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.668 2.245 . . . . 64.45 112.347 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.718 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.9 m170 70.2 36.87 0.12 Allowed Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.577 0.703 . . . . 74.34 110.88 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.718 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.5 Cg_endo -69.71 -165.37 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.64 2.227 . . . . 74.13 112.405 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.0 p -83.05 -32.64 26.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.267 -0.424 . . . . 63.14 110.913 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.567 HG23 ' HB3' ' A' ' 92' ' ' PHE . 18.5 m -49.17 -43.48 42.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.144 -0.48 . . . . 73.42 111.167 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.439 HD11 ' HG2' ' A' ' 108' ' ' GLN . 24.7 mm -58.96 -44.4 90.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 62.53 111.082 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.644 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -64.47 -28.85 69.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.466 . . . . 73.22 110.89 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.644 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.5 mp -81.14 -42.52 20.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.266 -0.424 . . . . 74.04 110.978 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.734 HD13 HG22 ' A' ' 74' ' ' ILE . 18.2 mt -61.54 -49.28 77.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 65.23 110.852 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.56 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.7 ptp180 -52.11 -39.41 59.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 60.54 110.864 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.56 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.8 m -88.34 -13.4 9.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.226 -0.443 . . . . 73.22 111.128 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.744 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -78.54 -39.88 36.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.162 -0.472 . . . . 72.21 110.923 179.979 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.526 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.4 OUTLIER -50.16 -31.33 13.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 72.41 110.881 179.857 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.43 -19.49 18.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.151 -0.477 . . . . 73.22 110.963 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.744 ' O ' HD13 ' A' ' 120' ' ' LEU . 46.5 m-70 -130.05 88.46 48.41 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.613 0.72 . . . . 61.53 110.867 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.658 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.4 Cg_endo -69.83 2.74 3.3 Favored 'Trans proline' 0 C--N 1.342 0.231 0 C-N-CA 122.652 2.235 . . . . 63.34 112.311 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -116.83 -11.68 10.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.274 -0.421 . . . . 74.54 110.837 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.668 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.4 tp -53.85 -46.38 71.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 71.22 110.883 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.523 HD13 HD11 ' A' ' 83' ' ' LEU . 1.6 pt? -50.11 -29.24 8.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 64.0 110.869 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.52 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.8 m-80 -86.57 -27.48 23.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 73.41 110.928 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.426 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -94.54 4.58 53.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.19 -0.459 . . . . 71.44 110.919 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.668 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.0 pt -123.84 -35.1 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 75.14 111.146 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.775 ' HB3' HD12 ' A' ' 91' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 65.42 110.936 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 mmt . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.836 0.351 . . . . 71.03 110.849 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.56 -169.49 0.44 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.246 -0.434 . . . . 75.44 110.893 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 1.7 p 178.7 55.67 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.385 0 CA-C-O 121.516 0.674 . . . . 43.34 110.899 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 53.4 Cg_endo -69.79 -8.67 24.2 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.709 2.272 . . . . 71.42 112.277 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.665 HG21 ' CD ' ' A' ' 42' ' ' GLU . 6.8 m -67.45 -49.56 70.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 73.21 111.132 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.463 ' N ' HG23 ' A' ' 5' ' ' VAL . 1.2 m -133.19 -20.96 2.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.171 -0.468 . . . . 61.32 110.893 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 66.65 89.01 0.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.216 -0.447 . . . . 72.33 110.909 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.639 HE21 ' N ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -132.26 -65.85 0.72 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.226 -0.443 . . . . 75.22 110.94 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.508 ' HA3' HG23 ' A' ' 38' ' ' VAL . . . -129.55 -96.0 0.78 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.745 -0.74 . . . . 52.11 112.441 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.589 ' HG2' HG22 ' A' ' 38' ' ' VAL . 8.6 pt-20 -177.0 95.28 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.87 0.367 . . . . 70.42 110.86 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.565 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -62.45 102.94 0.36 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 75.52 110.909 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.7 p -144.28 129.22 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.28 -0.418 . . . . 64.13 111.166 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.628 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -48.65 130.28 17.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.154 -0.476 . . . . 73.31 110.861 -179.793 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.421 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.66 80.71 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.752 -0.737 . . . . 74.04 112.487 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.421 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.3 146.21 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.851 0.358 . . . . 74.44 111.125 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.1 -165.49 1.73 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.123 -0.489 . . . . 73.34 110.914 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.654 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -95.62 117.76 31.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.265 -0.425 . . . . 75.12 110.846 179.912 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.73 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.4 mm -108.21 91.42 8.07 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.623 0.725 . . . . 71.03 111.13 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.438 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.7 Cg_endo -69.73 96.76 0.6 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.662 2.241 . . . . 61.1 112.322 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.483 ' HB3' HG23 ' A' ' 27' ' ' THR . 10.7 t80 -63.11 -37.69 88.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.198 -0.455 . . . . 63.41 110.882 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.478 HG23 ' HD3' ' A' ' 23' ' ' ARG . 11.0 m -127.55 146.97 50.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.472 . . . . 61.12 111.153 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -142.86 38.5 1.47 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.46 . . . . 73.4 110.86 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.478 ' HD3' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -129.64 -40.42 1.4 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.192 -0.458 . . . . 71.45 110.854 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -156.41 -58.98 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.691 -0.766 . . . . 64.21 112.459 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.475 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -90.28 47.04 1.39 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.872 0.367 . . . . 74.32 110.926 -179.878 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.406 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 11.8 tttm -54.61 113.35 1.27 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 73.32 110.936 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.483 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.8 t -127.13 92.68 3.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.241 -0.436 . . . . 73.42 111.092 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.654 HG11 ' HB2' ' A' ' 17' ' ' ASP . 44.3 t -77.06 126.87 38.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 73.31 111.133 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.742 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.64 51.19 2.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 62.31 110.921 179.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.41 ' C ' ' O ' ' A' ' 29' ' ' LEU . 22.8 mttp -37.73 108.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.466 . . . . 71.22 110.851 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.48 47.02 0.43 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.716 -0.754 . . . . 72.21 112.473 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.566 HD11 ' HB3' ' A' ' 29' ' ' LEU . 15.5 mm -107.92 90.95 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.824 0.345 . . . . 61.5 111.168 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.54 153.97 40.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.195 -0.457 . . . . 61.35 110.865 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.46 -109.0 0.32 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.714 -0.755 . . . . 52.54 112.445 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.776 HD12 ' HB ' ' A' ' 44' ' ' ILE . 56.0 mt -156.79 86.29 0.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.857 0.36 . . . . 71.4 110.885 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.433 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.34 163.16 33.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 74.14 110.854 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.1 t -164.31 -39.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 73.4 110.967 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.589 HG22 ' HG2' ' A' ' 10' ' ' GLU . 15.7 m -131.1 -44.57 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.133 -0.485 . . . . 53.44 111.115 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.432 ' N ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -89.47 169.7 11.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 71.53 110.787 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 98.2 m -134.94 7.14 3.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.153 -0.476 . . . . 74.13 110.934 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -94.03 -65.07 1.01 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.176 -0.465 . . . . 54.2 110.895 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.665 ' CD ' HG21 ' A' ' 5' ' ' VAL . 16.0 tp10 -76.21 61.29 1.59 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.133 -0.485 . . . . 65.02 110.929 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.9 p -100.13 158.4 15.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 74.12 110.902 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.776 ' HB ' HD12 ' A' ' 35' ' ' LEU . 20.6 mm -145.33 140.17 22.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 74.12 111.133 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.5 mtt -143.37 140.55 30.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 73.23 110.848 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 35.5 m-20 -88.54 -169.88 2.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 64.13 110.861 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -61.13 2.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.179 -0.464 . . . . 53.33 110.867 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.26 -57.29 9.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 74.32 110.846 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.04 -58.25 6.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 70.33 110.866 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.8 t -53.48 -42.2 67.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 71.31 110.844 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -57.46 -45.02 85.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.146 -0.479 . . . . 72.14 110.866 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.03 -61.71 2.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 63.45 111.114 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.429 ' CZ ' HG11 ' A' ' 57' ' ' VAL . 15.8 t80 -52.6 -48.59 66.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 75.51 110.779 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.436 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -61.52 -48.9 78.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.245 -0.434 . . . . 72.25 110.878 179.959 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.79 -43.27 62.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.236 -0.438 . . . . 62.54 111.128 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.742 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.7 mt-30 -68.76 -66.6 0.55 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 50.13 110.945 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.436 HG22 ' HA ' ' A' ' 54' ' ' MET . 15.0 m -47.5 -36.71 4.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.13 -0.486 . . . . 74.13 111.113 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 mmmt -67.02 -55.96 12.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 73.22 110.906 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.29 -53.05 23.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 72.22 111.145 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.613 ' O ' HG13 ' A' ' 64' ' ' VAL . 0.2 OUTLIER -62.85 -48.53 78.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 72.14 110.965 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -50.25 -38.47 40.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.126 -0.488 . . . . 72.02 110.855 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.67 -53.67 12.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.139 -0.482 . . . . 75.13 111.103 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.1 -26.95 63.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.152 -0.477 . . . . 54.3 110.864 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.613 HG13 ' O ' ' A' ' 60' ' ' PHE . 9.0 m -93.87 -19.56 6.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 72.4 111.109 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.84 -19.41 41.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 74.22 110.887 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.81 -22.18 34.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 75.05 111.108 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -50.35 -75.64 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.209 -0.45 . . . . 75.41 110.845 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.841 HG22 HG13 ' A' ' 69' ' ' VAL . 97.6 m -128.26 -78.1 0.57 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 74.54 111.169 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.841 HG13 HG22 ' A' ' 68' ' ' THR . 16.8 m -145.19 178.0 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 73.32 111.135 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.548 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -100.81 159.91 28.24 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.542 0.687 . . . . 43.12 111.132 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.74 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.3 Cg_endo -69.7 -6.78 19.4 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.657 2.238 . . . . 72.52 112.339 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -92.34 -40.24 11.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.271 -0.422 . . . . 71.53 110.841 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -57.77 -60.75 3.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 71.33 110.85 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.74 HD11 ' HA ' ' A' ' 71' ' ' PRO . 0.3 OUTLIER -44.18 -68.46 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.451 . . . . 74.21 111.126 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.3 m -49.03 -39.61 12.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 71.12 111.166 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.4 mtmt -59.42 -38.54 80.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 74.41 110.934 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.443 HG22 ' HB2' ' A' ' 121' ' ' ASP . 98.7 t -71.11 -39.22 73.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 74.5 111.089 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.8 OUTLIER -69.5 -30.59 68.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 54.24 110.918 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.64 -22.31 21.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.853 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -74.14 -50.88 17.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 71.23 110.953 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.852 HD13 HD12 ' A' ' 120' ' ' LEU . 8.1 mt -90.64 12.68 18.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 64.35 110.865 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.43 43.01 29.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 54.04 110.853 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.836 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.3 mm? -78.69 86.28 4.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.125 -0.489 . . . . 70.21 110.91 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.624 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -46.11 156.75 0.14 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.16 -0.473 . . . . 63.52 111.103 179.911 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -59.89 -22.69 62.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 75.24 110.905 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.1 -51.06 10.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 73.01 110.887 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.624 ' H ' HG23 ' A' ' 84' ' ' THR . 0.9 OUTLIER -66.48 -52.75 42.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 64.1 110.843 -179.983 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.509 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -54.95 -32.01 61.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.113 -0.494 . . . . 73.15 111.103 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.4 t -80.44 -35.08 35.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 62.4 110.869 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -76.3 -23.37 54.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 63.23 110.878 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.732 ' CD1' HD12 ' A' ' 127' ' ' LEU . 57.1 mt -102.09 -60.68 2.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.142 -0.481 . . . . 61.13 111.16 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.56 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.8 m-85 -78.51 -63.49 1.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.485 . . . . 75.43 110.903 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 111.32 47.17 0.76 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.8 -0.715 . . . . 44.31 112.466 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -69.21 -46.88 56.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.721 -0.752 . . . . 41.52 112.488 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 111.45 169.53 18.75 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.689 -0.767 . . . . 71.53 112.48 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.682 HG13 ' H ' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -51.22 -66.6 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.912 0.387 . . . . 62.22 111.222 179.992 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.682 ' H ' HG13 ' A' ' 96' ' ' VAL . 31.6 m-80 -86.07 40.67 0.88 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.099 -0.5 . . . . 71.14 110.876 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.76 -73.6 0.1 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 55.14 111.095 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -40.28 -46.21 2.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.465 . . . . 75.24 110.912 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.3 m -56.46 -74.74 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.087 -0.506 . . . . 74.31 110.902 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.522 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 10.1 mtt85 -48.38 -52.79 20.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.08 -0.509 . . . . 64.23 110.867 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.615 ' HB3' HD12 ' A' ' 74' ' ' ILE . 12.0 m-85 -50.76 -36.27 35.91 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.216 -0.447 . . . . 64.35 110.925 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -56.12 -39.7 72.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 74.53 110.862 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.74 -17.64 23.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 61.22 110.948 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.0 27.15 14.33 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.747 -0.74 . . . . 73.05 112.502 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 44.1 m-20 -96.38 -20.57 18.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.794 0.331 . . . . 71.23 110.911 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.522 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -108.54 17.35 22.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.09 -0.505 . . . . 22.02 111.151 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.483 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.4 tm0? -120.56 54.56 3.7 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.63 0.729 . . . . 71.14 110.935 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.429 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 54.1 Cg_endo -69.77 31.64 0.19 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.686 2.257 . . . . 64.45 112.361 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.696 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.0 m-70 69.02 38.46 0.18 Allowed Pre-proline 0 C--N 1.331 -0.237 0 CA-C-O 121.557 0.694 . . . . 74.34 110.854 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.696 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.5 Cg_endo -69.83 -165.71 0.16 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.619 2.212 . . . . 74.13 112.354 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 12.0 m -83.65 -33.54 25.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.237 -0.438 . . . . 63.14 110.904 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.56 HG23 ' HB3' ' A' ' 92' ' ' PHE . 15.5 m -48.87 -40.79 31.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.107 -0.497 . . . . 73.42 111.174 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.436 HD11 ' CG ' ' A' ' 108' ' ' GLN . 27.2 mm -61.08 -43.8 96.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 62.53 111.183 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.665 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -65.08 -28.91 69.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.084 -0.507 . . . . 73.22 110.843 179.867 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.665 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.5 mp -81.46 -42.98 19.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.231 -0.441 . . . . 74.04 110.911 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.614 HD13 HG22 ' A' ' 74' ' ' ILE . 30.2 mt -62.02 -49.36 76.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.185 -0.461 . . . . 65.23 110.856 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.577 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.6 ptp180 -51.61 -38.48 54.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 60.54 110.886 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.577 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.3 m -89.68 -13.99 9.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.169 -0.469 . . . . 73.22 111.134 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.852 HD12 HD13 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -77.62 -40.82 40.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 72.21 110.89 -179.993 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.443 ' HB2' HG22 ' A' ' 77' ' ' VAL . 7.6 t70 -49.32 -31.98 10.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.199 -0.455 . . . . 72.41 110.926 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.46 -21.2 17.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.147 -0.479 . . . . 73.22 110.884 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.755 ' O ' HD13 ' A' ' 120' ' ' LEU . 31.8 m-70 -127.56 88.21 54.2 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.606 0.717 . . . . 61.53 110.871 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.604 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.1 Cg_endo -69.74 3.53 2.71 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.716 2.277 . . . . 63.34 112.37 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -117.24 -12.69 10.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 74.54 110.937 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.663 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.2 tp -54.11 -46.79 72.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 71.22 110.954 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.732 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.41 -29.68 6.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.489 . . . . 64.0 110.903 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.492 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.27 -28.6 23.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 73.41 110.886 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.426 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -93.18 4.68 53.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.45 . . . . 71.44 110.91 -179.993 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.1 pt -123.81 -35.01 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 75.14 111.14 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.492 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 2.1 ptt-85 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 65.42 110.841 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.673 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 1.3 mmt . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.835 0.35 . . . . 71.03 110.871 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.82 -169.39 0.41 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 75.44 110.846 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.9 p 175.92 58.66 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.614 0.721 . . . . 43.34 110.924 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 1.15 4.67 Favored 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.698 2.265 . . . . 71.42 112.349 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.466 HG21 ' CB ' ' A' ' 42' ' ' GLU . 28.6 m -89.59 -41.97 14.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 73.21 111.213 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.438 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.7 OUTLIER -125.45 -31.37 3.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.152 -0.476 . . . . 61.32 110.896 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 66.6 53.42 0.93 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.202 -0.454 . . . . 72.33 110.85 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 85.7 mm-40 -112.38 -76.08 0.6 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.247 -0.433 . . . . 75.22 110.882 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.91 -109.47 3.27 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.702 -0.761 . . . . 52.11 112.449 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.673 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 7.6 pt-20 -177.46 98.3 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.888 0.375 . . . . 70.42 110.87 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.569 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -55.72 106.56 0.26 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.09 -0.505 . . . . 75.52 110.873 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.1 p -149.16 130.67 5.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 64.13 111.161 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.53 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -45.93 127.98 8.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.433 . . . . 73.31 110.893 -179.843 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.97 79.79 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.707 -0.758 . . . . 74.04 112.491 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.416 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.7 OUTLIER -36.97 146.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.881 0.372 . . . . 74.44 111.092 -179.931 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.58 -168.28 2.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.187 -0.46 . . . . 73.34 110.909 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -93.98 116.21 28.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 75.12 110.889 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.776 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.2 mm -107.98 90.66 6.8 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.572 0.701 . . . . 71.03 111.157 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.514 ' HB3' HG12 ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.75 104.19 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.657 2.238 . . . . 61.1 112.383 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -70.87 -30.97 67.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 63.41 110.926 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.5 HG21 ' HG2' ' A' ' 25' ' ' ARG . 21.6 m -128.21 147.44 50.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 61.12 111.167 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -146.35 30.49 1.02 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 73.4 110.884 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.421 ' HD3' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -118.63 -44.81 2.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.116 -0.493 . . . . 71.45 110.878 -179.873 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -151.22 -58.08 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.774 -0.727 . . . . 64.21 112.473 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.5 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -91.73 45.46 1.23 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.381 . . . . 74.32 110.869 -179.835 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.402 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 9.1 tttm -49.66 110.85 0.42 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 73.32 110.872 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.637 HG21 ' CD1' ' A' ' 60' ' ' PHE . 2.2 t -132.13 93.28 3.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 73.42 111.131 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.514 HG12 ' HB3' ' A' ' 19' ' ' PRO . 0.8 OUTLIER -80.82 139.83 17.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 73.31 111.13 179.924 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.776 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -86.09 63.6 8.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 62.31 110.921 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.0 mttp -42.26 104.55 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 71.22 110.918 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.493 ' O ' HD13 ' A' ' 32' ' ' ILE . . . 117.42 60.49 0.3 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.759 -0.734 . . . . 72.21 112.495 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.593 HD11 ' CB ' ' A' ' 29' ' ' LEU . 18.2 mm -116.78 92.34 2.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.807 0.337 . . . . 61.5 111.135 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.52 156.66 36.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.274 -0.421 . . . . 61.35 110.828 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 164.53 -107.66 0.31 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.713 -0.755 . . . . 52.54 112.464 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.716 HD12 ' HB ' ' A' ' 44' ' ' ILE . 49.8 mt -156.47 83.33 0.98 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.91 0.385 . . . . 71.4 110.916 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.538 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -165.66 168.79 15.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 74.14 110.935 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.1 t -177.06 -35.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 73.4 110.879 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.69 -49.01 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 53.44 111.134 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.79 173.93 7.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 71.53 110.786 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.8 p -147.8 36.3 0.86 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 74.13 110.843 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -112.36 -75.67 0.6 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 54.2 110.913 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.466 ' CB ' HG21 ' A' ' 5' ' ' VAL . 1.8 pm0 -79.06 60.4 2.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 65.02 110.912 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.2 p -83.73 159.48 21.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.463 . . . . 74.12 110.837 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.716 ' HB ' HD12 ' A' ' 35' ' ' LEU . 28.4 mm -142.76 140.65 27.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.056 -0.52 . . . . 74.12 111.123 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.1 mtt -145.66 141.16 27.85 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 73.23 110.88 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.0 m-20 -86.07 -169.93 2.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 64.13 110.908 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 6.6 mmpt? -57.8 -59.62 4.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 53.33 110.878 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.93 -57.76 8.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.26 -0.427 . . . . 74.32 110.925 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.58 -59.03 4.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.19 -0.459 . . . . 70.33 110.882 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.6 t -52.79 -38.22 60.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.134 -0.485 . . . . 71.31 110.871 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.54 -43.24 99.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.096 -0.502 . . . . 72.14 110.902 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.89 -58.78 5.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 63.45 111.073 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.505 ' O ' HG13 ' A' ' 57' ' ' VAL . 15.1 t80 -53.63 -47.64 70.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.251 -0.431 . . . . 75.51 110.937 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -50.98 67.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.117 -0.492 . . . . 72.25 110.877 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.02 -40.57 58.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 62.54 111.071 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.736 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.4 mt-30 -70.29 -67.48 0.49 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 50.13 110.876 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.505 HG13 ' O ' ' A' ' 53' ' ' PHE . 9.3 m -48.01 -34.58 4.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.227 -0.442 . . . . 74.13 111.13 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.3 mmmm -69.19 -56.71 6.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 73.22 110.882 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -48.99 -51.89 28.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.248 -0.433 . . . . 72.22 111.07 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.693 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.2 OUTLIER -62.83 -48.66 78.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.263 -0.426 . . . . 72.14 110.853 -179.875 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.54 -37.57 40.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.494 . . . . 72.02 110.866 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.0 -52.82 15.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 75.13 111.133 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.46 -31.31 67.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 54.3 110.791 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.693 HG22 ' O ' ' A' ' 60' ' ' PHE . 30.9 m -91.45 -16.54 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 72.4 111.087 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.91 -17.82 58.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 74.22 110.833 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -82.16 -18.45 42.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.435 . . . . 75.05 111.155 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -51.72 -75.19 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 75.41 110.866 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.942 HG22 HG13 ' A' ' 69' ' ' VAL . 97.2 m -53.04 -76.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 74.54 111.162 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.942 HG13 HG22 ' A' ' 68' ' ' THR . 14.7 m -135.85 -172.4 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.208 -0.451 . . . . 73.32 111.166 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.543 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.71 159.39 30.03 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.535 0.684 . . . . 43.12 111.124 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.543 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 54.1 Cg_endo -69.73 -7.81 22.01 Favored 'Trans proline' 0 C--N 1.341 0.132 0 C-N-CA 122.681 2.254 . . . . 72.52 112.367 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -95.77 -38.36 10.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.23 -0.441 . . . . 71.53 110.917 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -55.71 -61.6 2.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.126 -0.488 . . . . 71.33 110.859 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.692 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.42 -68.68 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.165 -0.47 . . . . 74.21 111.094 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.6 m -48.88 -39.03 11.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 71.12 111.149 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -60.82 -38.52 85.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 74.41 110.966 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.479 HG22 ' HB2' ' A' ' 121' ' ' ASP . 97.3 t -70.63 -38.29 72.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.455 . . . . 74.5 111.111 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 78' ' ' ARG . 1.1 mtp180 -69.58 -32.63 71.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 54.24 110.85 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.57 -18.97 24.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 74.11 110.877 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.463 ' HG2' HD23 ' A' ' 81' ' ' LEU . 2.0 ttmt -76.1 -51.46 12.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.276 -0.42 . . . . 71.23 110.916 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.817 ' HB2' HD23 ' A' ' 83' ' ' LEU . 8.5 mt -91.39 14.44 14.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 64.35 110.905 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.49 42.91 29.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.464 . . . . 54.04 110.904 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.817 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.3 mm? -78.71 84.36 4.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 70.21 110.895 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.612 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.78 155.92 0.23 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 63.52 111.177 179.918 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -57.82 -22.52 47.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 75.24 110.936 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.17 -53.31 7.1 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.174 -0.467 . . . . 73.01 110.869 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.612 ' H ' HG23 ' A' ' 84' ' ' THR . 4.2 tp10 -64.42 -55.68 19.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 64.1 110.936 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.536 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -51.22 -35.9 39.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 73.15 111.094 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 94.5 p -78.61 -32.24 47.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 62.4 110.82 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -74.62 -28.52 60.92 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.123 -0.49 . . . . 63.23 110.906 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.778 HD12 ' HB3' ' A' ' 131' ' ' ARG . 17.3 mm -99.9 -61.75 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 61.13 111.11 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.537 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.3 m-85 -73.42 -63.46 1.19 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 75.43 110.882 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 117.51 37.94 0.88 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.765 -0.731 . . . . 44.31 112.549 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -57.54 -52.18 53.41 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.782 -0.723 . . . . 41.52 112.463 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.11 -154.49 16.62 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.698 -0.763 . . . . 71.53 112.556 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.6 t -85.14 -67.2 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.882 0.372 . . . . 62.22 111.065 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -82.11 36.18 0.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.443 . . . . 71.14 110.923 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.38 -78.77 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.5 . . . . 55.14 111.076 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -38.09 -43.05 0.71 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 75.24 110.913 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.2 t -57.39 -76.6 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 74.31 110.929 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.562 ' HB3' ' HB2' ' A' ' 107' ' ' ALA . 54.6 mtt180 -50.06 -48.97 52.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.481 . . . . 64.23 110.861 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.498 ' HB3' HD12 ' A' ' 74' ' ' ILE . 8.7 m-85 -52.22 -36.33 51.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.144 -0.48 . . . . 64.35 110.911 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -55.73 -31.67 62.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.065 -0.516 . . . . 74.53 110.876 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.44 -17.21 15.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 61.22 110.899 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.18 26.65 15.44 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.773 -0.727 . . . . 73.05 112.517 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -99.04 -2.82 36.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.848 0.356 . . . . 71.23 110.839 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.562 ' HB2' ' HB3' ' A' ' 101' ' ' ARG . . . -121.95 17.09 10.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 22.02 111.139 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.43 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 0.0 OUTLIER -126.34 55.21 13.0 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.535 0.684 . . . . 71.14 110.871 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.501 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.9 Cg_endo -69.74 39.09 0.27 Allowed 'Trans proline' 0 C--N 1.341 0.135 0 C-N-CA 122.619 2.213 . . . . 64.45 112.424 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.734 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.3 m170 70.96 35.31 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.618 0.723 . . . . 74.34 110.861 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.734 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.5 Cg_endo -69.69 -164.15 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.765 2.31 . . . . 74.13 112.348 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.29 -27.27 22.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 63.14 110.844 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.537 HG23 ' HB3' ' A' ' 92' ' ' PHE . 48.1 m -58.74 -41.28 86.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.078 -0.51 . . . . 73.42 111.161 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.402 HD11 ' HB2' ' A' ' 108' ' ' GLN . 46.3 mm -61.76 -46.31 96.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 62.53 111.13 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.445 ' HZ2' HG11 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -66.45 -29.05 69.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.136 -0.484 . . . . 73.22 110.911 179.869 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.458 ' CD2' HD12 ' A' ' 130' ' ' ILE . 5.7 mp -79.64 -42.35 25.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.192 -0.458 . . . . 74.04 110.845 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.692 HD13 HG22 ' A' ' 74' ' ' ILE . 26.9 mt -62.97 -48.57 78.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 65.23 110.931 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.592 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.3 ptp180 -53.05 -35.2 59.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 60.54 110.884 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.592 HG13 ' HG3' ' A' ' 118' ' ' ARG . 30.6 m -93.45 -12.8 8.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 73.22 111.066 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.744 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -79.02 -39.21 34.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 72.21 110.897 -179.989 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.479 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.6 OUTLIER -50.61 -30.39 13.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.244 -0.435 . . . . 72.41 110.801 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.15 -19.42 17.92 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.204 -0.453 . . . . 73.22 110.89 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.744 ' O ' HD13 ' A' ' 120' ' ' LEU . 46.5 m-70 -130.27 88.29 48.28 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.544 0.687 . . . . 61.53 110.837 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.651 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.3 Cg_endo -69.69 2.57 3.37 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.724 2.283 . . . . 63.34 112.351 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -116.81 -11.52 10.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.225 -0.443 . . . . 74.54 110.925 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.666 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.5 tp -53.87 -46.32 71.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.108 -0.496 . . . . 71.22 110.884 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.514 HD13 HD11 ' A' ' 83' ' ' LEU . 1.7 pt? -49.97 -29.65 8.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.471 . . . . 64.0 110.922 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.507 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.34 -27.8 24.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.448 . . . . 73.41 110.878 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.427 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -93.59 3.69 55.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.185 -0.461 . . . . 71.44 110.914 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.666 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.7 pt -122.6 -34.82 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.496 . . . . 75.14 111.124 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.778 ' HB3' HD12 ' A' ' 91' ' ' ILE . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 65.42 110.833 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.546 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 3.9 mmt . . . . . 0 N--CA 1.458 -0.063 0 CA-C-O 120.841 0.353 . . . . 71.03 110.88 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.7 -169.31 0.42 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 75.44 110.915 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 p 176.73 58.26 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.636 0.731 . . . . 43.34 110.91 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.82 3.66 2.67 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.653 2.235 . . . . 71.42 112.247 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.5 m -95.05 -42.46 12.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.293 -0.412 . . . . 73.21 111.131 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.62 -32.53 3.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 61.32 110.835 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.8 m-70 65.37 49.94 1.81 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.466 . . . . 72.33 110.828 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -111.18 -75.24 0.62 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.442 . . . . 75.22 110.819 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -102.08 -109.51 3.28 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.768 -0.729 . . . . 52.11 112.444 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.546 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 9.4 pt-20 -177.29 98.16 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.852 0.358 . . . . 70.42 110.854 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.573 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -55.78 105.85 0.21 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 75.52 110.845 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.1 p -148.28 129.93 6.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.169 -0.469 . . . . 64.13 111.141 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.548 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -45.69 125.28 5.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 73.31 110.891 -179.863 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -178.0 81.83 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.774 -0.727 . . . . 74.04 112.564 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.408 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -38.15 148.65 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.873 0.368 . . . . 74.44 111.12 -179.955 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.41 -164.84 1.44 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.189 -0.459 . . . . 73.34 110.907 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.664 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -97.2 116.75 29.97 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.243 -0.435 . . . . 75.12 110.867 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.727 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.2 mm -107.65 91.83 7.85 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.671 0.748 . . . . 71.03 111.086 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.423 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.6 Cg_endo -69.82 96.08 0.58 Allowed 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.693 2.262 . . . . 61.1 112.305 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.52 ' HB3' HG23 ' A' ' 27' ' ' THR . 16.3 t80 -60.76 -39.63 89.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.187 -0.461 . . . . 63.41 110.945 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.44 HG22 ' H ' ' A' ' 23' ' ' ARG . 15.7 m -128.41 144.69 51.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.134 -0.484 . . . . 61.12 111.064 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -134.13 45.81 2.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 73.4 110.864 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.44 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -132.57 -68.28 0.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 71.45 110.874 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.83 -46.62 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.712 -0.756 . . . . 64.21 112.513 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.435 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.25 39.71 1.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.86 0.362 . . . . 74.32 110.891 -179.885 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -52.51 118.92 3.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.161 -0.472 . . . . 73.32 110.909 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.52 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -132.55 93.31 3.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.254 -0.43 . . . . 73.42 111.15 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.664 HG11 ' HB2' ' A' ' 17' ' ' ASP . 42.9 t -77.45 126.2 37.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 73.31 111.105 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.743 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.33 51.77 2.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.108 -0.496 . . . . 62.31 110.89 -180.0 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -38.83 107.03 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 71.22 110.937 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.8 45.07 0.39 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.713 -0.756 . . . . 72.21 112.465 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.576 HD11 ' HB3' ' A' ' 29' ' ' LEU . 14.2 mm -106.28 91.0 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.862 0.363 . . . . 61.5 111.118 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.09 158.23 34.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.103 -0.499 . . . . 61.35 110.878 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 164.81 -106.86 0.28 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.762 -0.733 . . . . 52.54 112.497 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.743 HD12 ' HB ' ' A' ' 44' ' ' ILE . 45.6 mt -156.68 82.71 0.96 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.824 0.345 . . . . 71.4 110.924 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.482 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -165.04 168.25 17.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 74.14 110.893 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -175.47 -36.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 73.4 110.868 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.0 -49.06 2.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 53.44 111.108 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.73 175.55 7.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 71.53 110.883 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.8 t -148.73 35.69 0.78 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.451 . . . . 74.13 110.881 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -111.84 -75.96 0.6 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.182 -0.463 . . . . 54.2 110.909 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -77.82 60.41 2.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 65.02 110.827 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.5 p -84.34 156.97 21.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.453 . . . . 74.12 110.84 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.743 ' HB ' HD12 ' A' ' 35' ' ' LEU . 26.6 mm -142.96 141.07 27.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 74.12 111.15 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 12.7 mtt -144.63 142.68 30.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.206 -0.452 . . . . 73.23 110.876 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.6 m-20 -88.04 -174.85 4.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.429 . . . . 64.13 110.858 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -59.65 4.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 53.33 110.872 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.66 -58.64 5.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.317 -0.401 . . . . 74.32 110.889 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -49.62 -54.17 19.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.491 . . . . 70.33 110.89 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.1 p -55.71 -44.0 77.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.101 -0.499 . . . . 71.31 110.845 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.74 -43.45 80.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 72.14 110.839 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.1 -63.0 1.21 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.165 -0.47 . . . . 63.45 111.118 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.491 ' O ' HG13 ' A' ' 57' ' ' VAL . 14.5 t80 -51.86 -46.1 64.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.241 -0.436 . . . . 75.51 110.895 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.425 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.69 -49.93 71.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.129 -0.487 . . . . 72.25 110.894 179.913 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.21 -42.38 60.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 62.54 111.059 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.743 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.5 mt-30 -69.87 -66.97 0.52 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.444 . . . . 50.13 110.889 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.9 m -47.31 -35.56 3.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 74.13 111.143 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -69.18 -54.34 15.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 73.22 110.973 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.67 -53.71 22.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 72.22 111.09 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.641 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -62.84 -48.14 80.35 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 72.14 110.881 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.65 -36.72 36.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 72.02 110.886 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.46 -53.62 10.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 75.13 111.07 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.23 -26.66 65.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 54.3 110.9 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 60' ' ' PHE . 17.2 m -96.14 -16.27 7.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.487 . . . . 72.4 111.094 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.17 -20.89 29.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 74.22 110.931 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.2 -21.1 31.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 75.05 111.155 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -51.57 -30.54 21.22 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.155 -0.475 . . . . 75.41 110.867 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 1.075 HG22 HG13 ' A' ' 69' ' ' VAL . 80.6 m -92.03 -77.84 0.42 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 74.54 111.132 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 1.075 HG13 HG22 ' A' ' 68' ' ' THR . 5.6 m -139.84 -178.36 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.204 -0.453 . . . . 73.32 111.103 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.4 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -101.21 154.88 36.92 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.575 0.702 . . . . 43.12 111.14 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.782 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.0 Cg_endo -69.77 -5.95 17.44 Favored 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.678 2.252 . . . . 72.52 112.332 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -93.67 -40.57 10.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.211 -0.45 . . . . 71.53 110.917 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.595 ' O ' HG23 ' A' ' 77' ' ' VAL . 19.6 t80 -57.06 -62.04 2.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 71.33 110.902 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.782 HD11 ' HA ' ' A' ' 71' ' ' PRO . 0.3 OUTLIER -39.8 -71.97 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 74.21 111.139 -179.981 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.402 HG23 ' N ' ' A' ' 76' ' ' LYS . 33.3 m -47.57 -38.73 6.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 71.12 111.142 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.402 ' N ' HG23 ' A' ' 75' ' ' VAL . 0.9 OUTLIER -62.82 -42.86 99.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 74.41 110.833 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.595 HG23 ' O ' ' A' ' 73' ' ' PHE . 25.3 t -62.78 -40.01 87.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 74.5 111.144 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.452 HH11 ' HD2' ' A' ' 78' ' ' ARG . 1.3 mtp85 -65.71 -55.03 19.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.444 . . . . 54.24 110.881 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.8 mmtp -66.48 -22.61 66.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 74.11 110.895 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -69.99 -52.98 19.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.464 . . . . 71.23 110.912 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.82 ' HB2' HD23 ' A' ' 83' ' ' LEU . 13.0 mt -89.84 13.63 14.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 64.35 110.908 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 53.65 38.7 28.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 54.04 110.831 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.82 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.6 mm? -78.73 81.75 5.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 70.21 110.919 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.562 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -44.57 156.79 0.07 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.214 -0.448 . . . . 63.52 111.122 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -54.18 -24.71 19.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.16 -0.473 . . . . 75.24 110.849 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.4 mtmt -79.14 -47.54 15.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.218 -0.446 . . . . 73.01 110.926 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.562 ' H ' HG23 ' A' ' 84' ' ' THR . 40.7 tt0 -65.28 -60.04 3.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.279 -0.419 . . . . 64.1 110.774 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.519 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -49.36 -34.92 17.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 73.15 111.085 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 84.9 p -77.78 -32.95 52.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 62.4 110.88 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -75.23 -29.98 60.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 63.23 110.882 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.735 HD12 ' CB ' ' A' ' 131' ' ' ARG . 17.8 mm -98.32 -63.08 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 61.13 111.1 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.562 ' HB3' HG23 ' A' ' 113' ' ' THR . 5.1 m-85 -73.11 -65.54 0.79 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.489 . . . . 75.43 110.896 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 125.21 32.6 0.78 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.719 -0.753 . . . . 44.31 112.459 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -51.92 -53.68 29.0 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.742 -0.742 . . . . 41.52 112.465 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 110.57 -136.23 13.44 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.687 -0.768 . . . . 71.53 112.506 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -98.24 -73.5 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.872 0.368 . . . . 62.22 111.127 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.64 42.66 0.98 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 71.14 110.889 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -59.7 -70.28 0.17 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.183 -0.462 . . . . 55.14 111.104 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -40.77 -48.78 3.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 75.24 110.88 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.7 m -55.13 -74.32 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 74.31 110.822 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.507 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 78.4 mtt180 -47.44 -55.17 9.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 64.23 110.865 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.651 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.0 m-85 -48.56 -36.57 15.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.178 -0.465 . . . . 64.35 110.917 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -57.1 -41.98 79.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.099 -0.5 . . . . 74.53 110.863 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.39 -15.66 30.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 61.22 110.868 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.42 25.64 23.01 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.735 -0.745 . . . . 73.05 112.519 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -93.68 -22.72 18.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 71.23 110.871 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.507 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -107.03 19.45 20.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.155 -0.475 . . . . 22.02 111.046 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.496 ' C ' ' H ' ' A' ' 110' ' ' HIS . 1.0 OUTLIER -121.23 53.42 3.57 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.652 0.739 . . . . 71.14 110.905 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.0 Cg_endo -69.8 28.49 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.683 2.256 . . . . 64.45 112.286 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.711 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.8 m-70 70.38 36.98 0.12 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.566 0.698 . . . . 74.34 110.838 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.711 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.7 Cg_endo -69.68 -165.27 0.15 Allowed 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.727 2.285 . . . . 74.13 112.369 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.7 p -82.04 -33.13 30.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.039 0.447 . . . . 63.14 110.88 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.587 HG22 ' CD1' ' A' ' 117' ' ' LEU . 23.0 m -49.25 -43.02 42.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.028 -0.533 . . . . 73.42 111.179 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.432 HD11 ' CG ' ' A' ' 108' ' ' GLN . 27.2 mm -60.82 -47.08 94.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 62.53 111.144 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.633 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -61.61 -27.7 68.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.145 -0.479 . . . . 73.22 110.942 179.901 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.633 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.4 mp -82.32 -45.64 14.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.203 -0.453 . . . . 74.04 110.848 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.78 HD13 HG22 ' A' ' 74' ' ' ILE . 14.5 mt -57.51 -46.89 83.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.44 . . . . 65.23 110.949 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.589 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.8 ptp180 -55.62 -35.08 65.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.488 . . . . 60.54 110.849 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.589 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.3 m -95.54 -5.37 10.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 73.22 111.157 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.742 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -88.84 -41.06 12.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.11 -0.496 . . . . 72.21 110.882 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -49.93 -31.82 13.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 72.41 110.876 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.11 -19.09 18.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 73.22 110.984 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.742 ' O ' HD13 ' A' ' 120' ' ' LEU . 47.7 m-70 -128.61 88.24 52.73 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.539 0.685 . . . . 61.53 110.83 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.581 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.7 Cg_endo -69.75 2.64 3.35 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.677 2.252 . . . . 63.34 112.357 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -115.73 -13.0 11.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.213 -0.448 . . . . 74.54 110.857 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.657 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.6 tp -54.49 -46.0 73.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.173 -0.467 . . . . 71.22 110.862 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.466 ' HB3' HD11 ' A' ' 120' ' ' LEU . 0.8 OUTLIER -49.18 -30.12 6.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 64.0 110.931 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.456 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.2 m-80 -85.52 -29.93 23.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 73.41 110.935 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.422 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.0 OUTLIER -91.23 4.61 51.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 71.44 110.822 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.657 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.3 pt -124.06 -34.94 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.202 -0.453 . . . . 75.14 111.138 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.735 ' CB ' HD12 ' A' ' 91' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 65.42 110.84 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mtt . . . . . 0 C--O 1.23 0.043 0 CA-C-O 120.837 0.351 . . . . 71.03 110.927 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.4 -169.33 0.44 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 75.44 110.941 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.445 ' O ' ' N ' ' A' ' 7' ' ' HIS . 0.1 OUTLIER 174.88 57.99 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.569 0.7 . . . . 43.34 110.938 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.75 -0.59 7.13 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.649 2.232 . . . . 71.42 112.353 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.479 HG21 ' CD ' ' A' ' 42' ' ' GLU . 29.5 m -90.01 -44.33 14.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.435 . . . . 73.21 111.119 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.457 ' N ' HG23 ' A' ' 5' ' ' VAL . 14.2 p -119.51 -27.65 5.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 61.32 110.88 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.445 ' N ' ' O ' ' A' ' 3' ' ' CYS . 43.6 m-70 62.63 53.67 2.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 72.33 110.868 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -119.41 -75.16 0.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 75.22 110.956 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -98.87 -133.72 8.18 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.668 -0.777 . . . . 52.11 112.51 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.478 ' O ' HG12 ' A' ' 12' ' ' VAL . 6.1 pt-20 -156.06 87.41 1.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.863 0.363 . . . . 70.42 110.926 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.556 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -48.69 105.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 75.52 110.826 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.478 HG12 ' O ' ' A' ' 10' ' ' GLU . 4.2 p -141.85 126.48 16.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 64.13 111.163 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.587 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.3 p -49.27 131.71 19.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 73.31 110.908 -179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.411 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 177.98 80.66 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.805 -0.712 . . . . 74.04 112.481 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.411 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -37.08 146.9 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.882 0.372 . . . . 74.44 111.106 -179.985 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.24 -165.1 1.51 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 73.34 110.9 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.64 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -95.64 117.21 30.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.268 -0.424 . . . . 75.12 110.89 179.857 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.727 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.2 mm -107.79 91.23 7.22 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.62 0.724 . . . . 71.03 111.124 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 96.15 0.58 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.685 2.257 . . . . 61.1 112.364 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.549 ' HB3' HG23 ' A' ' 27' ' ' THR . 6.5 t80 -60.96 -35.83 77.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 63.41 110.934 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.435 HG21 ' HG2' ' A' ' 25' ' ' ARG . 6.4 m -132.37 144.38 50.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 61.12 111.187 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -133.58 45.77 2.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 73.4 110.915 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.416 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -132.45 -68.46 0.61 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.085 -0.507 . . . . 71.45 110.832 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.52 -47.31 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.749 -0.739 . . . . 64.21 112.529 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.435 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.24 40.8 1.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.797 0.332 . . . . 74.32 110.856 -179.893 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.2 tttm -53.92 117.64 3.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.189 -0.46 . . . . 73.32 110.92 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.549 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -130.07 92.85 3.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 73.42 111.134 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.64 HG11 ' HB2' ' A' ' 17' ' ' ASP . 40.7 t -77.31 125.88 37.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 73.31 111.115 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.734 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.84 51.55 2.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 62.31 110.889 179.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.9 mttm -37.94 108.06 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 71.22 110.923 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.66 47.08 0.42 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.738 -0.744 . . . . 72.21 112.527 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.581 HD11 ' HB3' ' A' ' 29' ' ' LEU . 14.8 mm -107.99 90.95 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.856 0.36 . . . . 61.5 111.113 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.89 154.14 39.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 61.35 110.839 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 168.25 -109.37 0.34 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.716 -0.754 . . . . 52.54 112.478 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.749 HD12 ' HB ' ' A' ' 44' ' ' ILE . 58.4 mt -156.89 86.86 0.98 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.815 0.34 . . . . 71.4 110.894 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -159.44 160.19 34.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 74.14 110.963 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 32.2 t -171.85 -39.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.162 -0.472 . . . . 73.4 110.918 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.409 HG13 ' N ' ' A' ' 39' ' ' HIS . 2.6 p -123.26 -46.6 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.121 -0.49 . . . . 53.44 111.045 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.409 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -91.82 171.03 9.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.23 -0.441 . . . . 71.53 110.846 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.84 19.8 2.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 74.13 110.892 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -110.27 -63.13 1.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.255 -0.43 . . . . 54.2 110.876 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.479 ' CD ' HG21 ' A' ' 5' ' ' VAL . 13.1 tp10 -76.87 61.94 2.0 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.124 -0.489 . . . . 65.02 110.914 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.7 p -95.42 154.81 17.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.078 -0.51 . . . . 74.12 110.846 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.749 ' HB ' HD12 ' A' ' 35' ' ' LEU . 18.2 mm -142.41 139.48 29.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 74.12 111.135 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.6 mtt -141.62 145.22 34.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 73.23 110.901 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.0 m-20 -90.55 -170.51 2.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 64.13 110.873 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.24 -61.08 2.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 53.33 110.853 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -51.49 -57.43 9.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 74.32 110.878 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.29 -58.67 5.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 70.33 110.875 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.7 t -52.18 -43.94 64.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 71.31 110.873 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.92 -44.02 81.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.119 -0.491 . . . . 72.14 110.895 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.46 -63.19 1.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 63.45 111.045 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.482 ' O ' HG13 ' A' ' 57' ' ' VAL . 14.4 t80 -51.63 -47.42 63.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.288 -0.414 . . . . 75.51 110.927 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.427 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.37 -49.37 75.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 72.25 110.844 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.52 -43.11 62.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.258 -0.428 . . . . 62.54 111.153 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.734 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.6 mt-30 -69.28 -66.73 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 50.13 110.875 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.482 HG13 ' O ' ' A' ' 53' ' ' PHE . 11.4 m -47.27 -37.02 4.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.277 -0.42 . . . . 74.13 111.058 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -67.17 -54.79 17.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 73.22 110.829 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.32 -52.32 28.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.441 . . . . 72.22 111.084 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.718 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -64.83 -50.08 68.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.281 -0.418 . . . . 72.14 110.818 -179.912 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.41 -34.99 26.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 72.02 110.881 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.26 -56.19 5.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 75.13 111.066 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.89 -32.21 52.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 54.3 110.81 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.718 HG22 ' O ' ' A' ' 60' ' ' PHE . 34.3 m -89.03 -24.79 5.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.165 -0.47 . . . . 72.4 111.131 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.87 -20.03 14.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.169 -0.469 . . . . 74.22 110.877 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -48.35 -34.3 10.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.192 -0.458 . . . . 75.05 111.107 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.09 -55.77 15.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.235 -0.438 . . . . 75.41 110.836 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.744 HG22 HG13 ' A' ' 69' ' ' VAL . 96.8 m -163.51 -78.66 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 74.54 111.148 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.744 HG13 HG22 ' A' ' 68' ' ' THR . 16.0 m -148.93 -173.66 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.151 -0.477 . . . . 73.32 111.159 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.567 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.2 160.15 27.21 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.535 0.683 . . . . 43.12 111.079 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.567 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.7 Cg_endo -69.79 -8.2 22.99 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.634 2.222 . . . . 72.52 112.324 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.41 -37.46 10.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 71.53 110.924 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -55.94 -59.42 4.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 71.33 110.835 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.748 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -46.27 -69.32 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.18 -0.464 . . . . 74.21 111.139 -179.973 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.3 m -47.54 -38.02 5.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 71.12 111.145 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -61.59 -45.2 95.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.485 . . . . 74.41 110.916 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.648 HG22 ' HB2' ' A' ' 121' ' ' ASP . 72.6 t -63.03 -38.92 83.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.444 . . . . 74.5 111.134 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.483 HH22 HG21 ' A' ' 113' ' ' THR . 0.1 OUTLIER -64.23 -54.79 27.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 54.24 110.892 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.99 -21.61 64.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 74.11 110.909 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -70.11 -53.69 16.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 71.23 110.896 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.824 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.6 mt -90.89 13.88 15.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 64.35 110.896 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 52.64 38.64 26.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 54.04 110.819 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.824 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.8 mm? -79.01 86.48 4.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.137 -0.483 . . . . 70.21 110.909 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.651 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.82 156.74 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 63.52 111.175 179.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -56.88 -22.07 34.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 75.24 110.937 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.63 -52.42 7.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 73.01 110.903 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.651 ' H ' HG23 ' A' ' 84' ' ' THR . 4.1 tp10 -58.93 -55.38 35.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 64.1 110.919 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.449 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -50.85 -31.64 17.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.49 . . . . 73.15 111.067 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 7.5 p -80.97 -32.13 34.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.435 . . . . 62.4 110.899 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.77 -21.82 54.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.075 -0.511 . . . . 63.23 110.887 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.751 HD12 ' HB3' ' A' ' 131' ' ' ARG . 22.4 mm -107.37 -61.71 2.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.47 . . . . 61.13 111.082 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.566 ' HB3' HG23 ' A' ' 113' ' ' THR . 4.5 m-85 -75.91 -64.04 1.17 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 75.43 110.852 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 116.49 49.21 0.44 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.763 -0.732 . . . . 44.31 112.443 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -72.03 -36.72 60.58 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.743 -0.741 . . . . 41.52 112.516 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.03 -123.52 7.15 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.727 -0.749 . . . . 71.53 112.474 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.489 HG22 ' N ' ' A' ' 97' ' ' ASN . 0.1 OUTLIER -120.46 -62.03 2.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 62.22 111.1 -179.986 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.489 ' N ' HG22 ' A' ' 96' ' ' VAL . 12.8 p30 -85.61 39.94 0.82 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 71.14 110.914 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.425 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -60.74 -77.54 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 55.14 111.068 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.425 ' C ' ' O ' ' A' ' 98' ' ' ALA . 54.7 m-85 -35.91 -46.74 0.48 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 75.24 110.884 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -57.35 -76.4 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 74.31 110.865 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.53 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 8.9 mtt180 -47.92 -52.73 18.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 64.23 110.865 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.632 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.6 m-85 -49.04 -38.62 24.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 64.35 110.949 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -52.79 -41.33 64.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.087 -0.506 . . . . 74.53 110.854 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.79 -17.24 24.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 61.22 110.977 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 94.08 25.51 16.78 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.757 -0.735 . . . . 73.05 112.505 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -92.89 -23.37 18.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.882 0.373 . . . . 71.23 110.938 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.53 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -103.86 17.22 24.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 22.02 111.079 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.499 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.9 OUTLIER -120.3 55.02 3.72 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.605 0.717 . . . . 71.14 110.98 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 54.1 Cg_endo -69.66 27.6 0.17 Allowed 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.633 2.222 . . . . 64.45 112.396 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.718 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.8 m-70 70.34 37.17 0.13 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.595 0.712 . . . . 74.34 110.869 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.718 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.5 Cg_endo -69.75 -165.25 0.15 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.67 2.247 . . . . 74.13 112.306 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 31.8 m -83.27 -33.44 26.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 63.14 110.818 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.566 HG23 ' HB3' ' A' ' 92' ' ' PHE . 23.9 m -49.09 -41.66 36.35 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.116 -0.493 . . . . 73.42 111.141 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.535 HG21 ' CG2' ' A' ' 68' ' ' THR . 25.1 mm -60.6 -44.16 96.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.266 -0.425 . . . . 62.53 111.1 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.635 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -64.28 -29.18 70.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 73.22 110.927 179.87 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.635 HD12 ' HG3' ' A' ' 115' ' ' LYS . 7.4 mp -81.23 -43.24 19.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 74.04 110.937 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.748 HD13 HG22 ' A' ' 74' ' ' ILE . 18.5 mt -60.5 -49.06 79.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.228 -0.442 . . . . 65.23 110.939 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.565 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.2 ptp180 -52.86 -38.52 61.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 60.54 110.843 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.565 HG13 ' HG3' ' A' ' 118' ' ' ARG . 33.4 m -89.86 -11.08 10.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 73.22 111.094 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.768 HD12 HD13 ' A' ' 81' ' ' LEU . 0.5 OUTLIER -81.6 -39.87 23.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.206 -0.452 . . . . 72.21 110.925 179.927 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.648 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.4 OUTLIER -50.85 -30.38 14.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 72.41 110.832 179.9 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -98.3 -18.3 18.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 73.22 110.956 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.752 ' O ' HD13 ' A' ' 120' ' ' LEU . 59.7 m-70 -130.56 88.69 46.15 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.615 0.721 . . . . 61.53 110.879 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.695 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.2 Cg_endo -69.77 2.61 3.38 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.707 2.272 . . . . 63.34 112.367 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -116.44 -12.22 11.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 74.54 110.859 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.657 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.5 tp -54.22 -46.64 72.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 71.22 110.862 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.486 HD13 HD11 ' A' ' 83' ' ' LEU . 1.3 pt? -49.36 -29.59 6.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 64.0 110.901 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.49 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.0 m-80 -86.16 -29.29 23.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.224 -0.444 . . . . 73.41 110.864 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.426 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -92.29 4.68 52.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 71.44 110.946 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.657 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.1 pt -124.04 -34.95 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.099 -0.501 . . . . 75.14 111.143 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.751 ' HB3' HD12 ' A' ' 91' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 65.42 110.899 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mmt . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.818 0.342 . . . . 71.03 110.822 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.78 -170.73 0.5 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 75.44 110.859 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 1.7 p 178.05 56.22 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.53 0.681 . . . . 43.34 110.794 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.405 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 55.2 Cg_endo -69.72 -8.83 24.6 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.699 2.266 . . . . 71.42 112.37 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.67 HG21 ' CD ' ' A' ' 42' ' ' GLU . 6.0 m -67.21 -49.98 67.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 73.21 111.115 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.464 ' N ' HG23 ' A' ' 5' ' ' VAL . 1.2 m -133.2 -21.1 2.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.093 -0.503 . . . . 61.32 110.845 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 66.91 88.96 0.1 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.253 -0.431 . . . . 72.33 110.87 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.636 HE21 ' N ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -132.34 -66.57 0.69 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.249 -0.432 . . . . 75.22 110.933 -179.895 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -127.37 -92.9 0.8 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.814 -0.707 . . . . 52.11 112.529 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 178.34 91.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.838 0.351 . . . . 70.42 110.845 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.57 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.0 OUTLIER -57.23 99.65 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 75.52 110.865 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -139.7 128.95 28.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 64.13 111.152 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.619 ' N ' HD23 ' A' ' 35' ' ' LEU . 42.3 m -48.87 130.44 18.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.182 -0.463 . . . . 73.31 110.852 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.404 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 177.49 82.13 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.658 -0.782 . . . . 74.04 112.471 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.428 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.7 OUTLIER -37.59 147.17 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.881 0.372 . . . . 74.44 111.118 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.56 -168.61 2.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.454 . . . . 73.34 110.886 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.712 ' HB3' HG21 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -95.02 113.6 25.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 75.12 110.868 179.874 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.758 ' O ' HD22 ' A' ' 29' ' ' LEU . 5.7 mm -106.67 88.5 3.5 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.609 0.719 . . . . 71.03 111.125 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.526 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 54.1 Cg_endo -69.75 99.52 0.75 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.699 2.266 . . . . 61.1 112.374 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -65.07 -32.47 74.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.279 -0.419 . . . . 63.41 110.917 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.544 HG21 ' HG2' ' A' ' 25' ' ' ARG . 23.5 m -130.68 147.83 52.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.129 -0.487 . . . . 61.12 111.098 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -147.7 35.14 0.85 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 73.4 110.864 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.424 ' HD3' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -122.48 -43.0 2.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 71.45 110.926 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -154.56 -52.96 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.741 -0.742 . . . . 64.21 112.504 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.544 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -96.51 44.77 1.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.856 0.36 . . . . 74.32 110.886 -179.86 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.427 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 9.9 tttm -50.11 118.39 2.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 73.32 110.903 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.403 ' O ' HG23 ' A' ' 27' ' ' THR . 2.0 t -136.46 82.88 1.97 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 73.42 111.157 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.712 HG21 ' HB3' ' A' ' 17' ' ' ASP . 1.7 p -73.96 133.82 30.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.201 -0.454 . . . . 73.31 111.186 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.781 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.2 OUTLIER -84.41 53.73 2.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 62.31 110.894 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.403 ' C ' ' O ' ' A' ' 29' ' ' LEU . 13.8 mttm -37.07 105.88 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 71.22 110.895 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.47 50.8 0.36 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.736 -0.745 . . . . 72.21 112.527 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.647 HD11 ' CB ' ' A' ' 29' ' ' LEU . 22.9 mm -107.36 96.53 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.817 0.341 . . . . 61.5 111.115 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -77.57 153.26 33.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 61.35 110.825 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.19 -108.43 0.31 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.745 -0.74 . . . . 52.54 112.545 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.734 HD12 ' HB ' ' A' ' 44' ' ' ILE . 48.4 mt -156.88 85.8 0.97 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.858 0.361 . . . . 71.4 110.892 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.534 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -162.3 164.54 27.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 74.14 110.95 179.956 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 43.0 t -168.31 -38.76 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.145 -0.48 . . . . 73.4 110.9 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.1 m -128.44 -45.63 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 53.44 111.18 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.02 169.28 11.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 71.53 110.889 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 10.6 p -134.93 7.38 3.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.223 -0.444 . . . . 74.13 110.849 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -94.55 -65.02 1.01 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 54.2 110.921 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.67 ' CD ' HG21 ' A' ' 5' ' ' VAL . 13.4 tp10 -76.49 61.56 1.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.101 -0.5 . . . . 65.02 110.885 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.3 p -99.92 158.31 15.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.091 -0.504 . . . . 74.12 110.887 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.734 ' HB ' HD12 ' A' ' 35' ' ' LEU . 23.9 mm -142.37 140.18 29.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.491 . . . . 74.12 111.139 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.3 mtm -145.14 132.04 20.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 73.23 110.837 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 -84.91 -170.42 3.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.443 . . . . 64.13 110.845 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -55.22 32.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 53.33 110.985 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.38 -55.57 33.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.181 -0.463 . . . . 74.32 110.836 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -52.29 -60.83 2.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 70.33 110.892 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.7 t -54.71 -38.03 66.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 71.31 110.876 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -59.15 -45.7 90.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.126 -0.488 . . . . 72.14 110.869 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.48 -57.94 7.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 63.45 111.057 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.49 ' O ' HG13 ' A' ' 57' ' ' VAL . 14.1 t80 -54.16 -46.99 72.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 75.51 110.92 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.425 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -64.57 -50.27 67.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.14 -0.482 . . . . 72.25 110.879 179.976 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.22 -40.64 59.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 62.54 111.066 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.781 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.6 mt-30 -71.02 -67.51 0.5 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.452 . . . . 50.13 110.921 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.556 HG12 HD21 ' A' ' 29' ' ' LEU . 12.4 m -47.24 -35.19 3.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.179 -0.464 . . . . 74.13 111.15 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -70.97 -51.26 26.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 73.22 110.897 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.77 -49.43 62.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.263 -0.426 . . . . 72.22 111.124 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.65 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.4 OUTLIER -67.0 -48.09 69.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 72.14 110.808 -179.913 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.12 -50.12 49.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 72.02 110.899 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.62 -54.37 32.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 75.13 111.066 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.87 -38.81 37.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 54.3 110.881 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 60' ' ' PHE . 37.2 t -81.86 -25.47 9.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 72.4 111.104 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.411 ' HB2' ' HA ' ' A' ' 109' ' ' PRO . 0.0 OUTLIER -64.14 -21.61 66.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 74.22 110.852 -179.986 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.46 4.1 33.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 75.05 111.176 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -104.62 -28.26 11.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 75.41 110.883 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.904 HG22 HG13 ' A' ' 69' ' ' VAL . 61.2 m -50.52 -72.64 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.119 -0.491 . . . . 74.54 111.131 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.904 HG13 HG22 ' A' ' 68' ' ' THR . 11.5 m -138.08 -174.58 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.234 -0.439 . . . . 73.32 111.135 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.547 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -105.41 159.86 28.02 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.624 0.726 . . . . 43.12 111.101 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.594 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.8 Cg_endo -69.75 -7.14 20.31 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.678 2.252 . . . . 72.52 112.379 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.98 -37.98 11.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.219 -0.446 . . . . 71.53 110.892 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -57.51 -61.61 2.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 71.33 110.879 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.8 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.87 -67.32 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 74.21 111.099 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.0 m -49.3 -39.12 12.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 71.12 111.099 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -60.88 -45.72 93.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 74.41 110.898 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.538 HG22 ' HB2' ' A' ' 121' ' ' ASP . 76.7 t -61.33 -39.12 81.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 74.5 111.167 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.54 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -64.08 -59.34 4.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 54.24 110.915 179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -22.72 67.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.926 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -69.21 -53.13 21.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 71.23 110.905 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.806 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.6 mt -90.69 12.95 17.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 64.35 110.931 179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 54.54 37.51 28.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.429 . . . . 54.04 110.871 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.806 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.8 mm? -80.02 87.11 5.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.109 -0.496 . . . . 70.21 110.899 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.648 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.77 157.17 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 63.52 111.142 179.961 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -57.6 -21.33 38.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 75.24 110.948 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.0 mmtp -81.3 -49.89 10.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.442 . . . . 73.01 110.914 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.648 ' H ' HG23 ' A' ' 84' ' ' THR . 7.2 tp10 -62.31 -52.36 63.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.436 . . . . 64.1 110.913 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.76 -36.49 67.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 73.15 111.084 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 30.6 t -79.18 -26.34 42.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 62.4 110.856 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -81.15 -27.69 35.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 63.23 110.883 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.732 HD12 ' HB3' ' A' ' 131' ' ' ARG . 26.5 mm -101.11 -59.09 3.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.116 -0.493 . . . . 61.13 111.172 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.596 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.7 m-85 -75.7 -61.29 1.97 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 75.43 110.878 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.32 48.98 0.78 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.754 -0.736 . . . . 44.31 112.471 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.61 -38.91 31.12 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.737 -0.744 . . . . 41.52 112.499 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 106.98 165.56 22.28 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.749 -0.738 . . . . 71.53 112.52 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.5 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.8 p -51.4 -51.39 24.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.896 0.379 . . . . 62.22 111.135 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.5 ' N ' HG13 ' A' ' 96' ' ' VAL . 9.0 t30 -87.24 39.17 0.85 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 71.14 110.866 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.7 -76.28 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 55.14 111.108 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -43.41 -39.72 3.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.439 . . . . 75.24 110.91 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 38.9 t -59.95 -75.57 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 74.31 110.818 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.624 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 36.2 mtt180 -50.61 -45.21 57.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 64.23 110.829 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.723 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.4 m-85 -56.25 -36.67 68.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.268 -0.423 . . . . 64.35 110.932 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -52.13 -28.99 19.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.122 -0.49 . . . . 74.53 110.854 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.77 -22.63 12.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.203 -0.453 . . . . 61.22 110.862 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.92 27.19 9.07 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.772 -0.727 . . . . 73.05 112.498 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -98.13 -6.62 31.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.791 0.329 . . . . 71.23 110.879 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.624 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -110.33 10.15 23.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 22.02 111.126 179.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.577 ' HB2' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -125.14 57.27 15.79 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.598 0.714 . . . . 71.14 110.947 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.533 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.2 Cg_endo -69.82 36.68 0.24 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.671 2.247 . . . . 64.45 112.341 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.775 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.7 OUTLIER 73.9 32.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.554 0.693 . . . . 74.34 110.835 179.918 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.775 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.6 Cg_endo -69.74 -163.99 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.764 2.31 . . . . 74.13 112.322 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.4 p -86.65 -29.4 22.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.435 . . . . 63.14 110.84 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.599 HG22 HD12 ' A' ' 117' ' ' LEU . 34.5 m -53.41 -50.76 64.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.089 -0.505 . . . . 73.42 111.112 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.577 HD11 ' HB2' ' A' ' 108' ' ' GLN . 43.3 mm -51.34 -42.5 27.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.264 -0.425 . . . . 62.53 111.136 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.541 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -67.98 -29.86 69.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.225 -0.443 . . . . 73.22 110.868 179.838 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.541 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.7 mp -79.11 -41.64 28.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.277 -0.42 . . . . 74.04 110.886 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.8 HD13 HG22 ' A' ' 74' ' ' ILE . 14.8 mt -64.32 -49.27 72.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.149 -0.478 . . . . 65.23 110.962 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.595 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.3 ptp180 -51.92 -34.94 43.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 60.54 110.886 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.595 HG13 ' HG3' ' A' ' 118' ' ' ARG . 29.5 m -93.57 -14.74 8.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 73.22 111.194 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.769 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -76.05 -39.33 55.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 72.21 110.966 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.538 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.9 OUTLIER -50.67 -30.52 13.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.227 -0.442 . . . . 72.41 110.859 179.793 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -96.72 -20.01 18.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 73.22 110.886 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.769 ' O ' HD13 ' A' ' 120' ' ' LEU . 65.6 m-70 -131.21 90.05 39.76 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 121.619 0.723 . . . . 61.53 110.881 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.725 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.0 Cg_endo -69.69 -0.07 6.32 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.758 2.305 . . . . 63.34 112.345 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -113.48 -11.92 13.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.216 -0.447 . . . . 74.54 110.902 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.683 ' O ' HG23 ' A' ' 130' ' ' ILE . 6.3 tp -53.81 -47.78 70.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.149 -0.478 . . . . 71.22 110.845 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.739 HD13 HD11 ' A' ' 83' ' ' LEU . 2.1 pt? -51.1 -28.95 11.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 64.0 110.934 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.492 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.73 -26.05 24.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 73.41 110.869 179.929 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.411 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.0 OUTLIER -96.02 3.52 53.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 71.44 110.86 -179.978 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.683 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.7 pt -122.41 -34.49 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 75.14 111.207 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.732 ' HB3' HD12 ' A' ' 91' ' ' ILE . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 65.42 110.875 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.543 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 3.1 mmt . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.843 0.354 . . . . 71.03 110.919 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.7 -169.61 0.43 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.429 . . . . 75.44 110.903 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 p 176.92 57.84 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.677 0.751 . . . . 43.34 110.872 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 3.71 2.62 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.679 2.253 . . . . 71.42 112.332 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.2 m -95.66 -42.46 12.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 73.21 111.143 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.38 -32.69 3.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.15 -0.477 . . . . 61.32 110.831 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 65.35 51.02 1.64 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 72.33 110.851 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 94.8 mm-40 -114.59 -75.42 0.59 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 75.22 110.9 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -99.18 -112.43 3.3 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.79 -0.719 . . . . 52.11 112.526 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.543 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 8.0 pt-20 -175.81 97.12 0.07 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.81 0.338 . . . . 70.42 110.92 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.566 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.4 ptp -55.64 106.14 0.23 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 75.52 110.895 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.3 p -148.63 129.61 5.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.218 -0.446 . . . . 64.13 111.16 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.53 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -45.3 125.21 5.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 73.31 110.844 -179.84 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.9 82.17 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.759 -0.734 . . . . 74.04 112.488 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.407 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -38.34 148.87 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.864 0.364 . . . . 74.44 111.133 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.47 -164.74 1.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 73.34 110.9 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.657 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -97.4 116.66 30.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.211 -0.449 . . . . 75.12 110.871 179.86 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.722 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.4 mm -107.56 91.78 7.65 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.607 0.718 . . . . 71.03 111.158 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.422 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.6 Cg_endo -69.7 95.81 0.56 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.751 2.301 . . . . 61.1 112.379 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.504 ' HB3' HG23 ' A' ' 27' ' ' THR . 15.5 t80 -60.18 -40.39 89.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.0 0.428 . . . . 63.41 110.875 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.457 HG21 ' HG2' ' A' ' 25' ' ' ARG . 14.6 m -127.83 145.23 51.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 61.12 111.159 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -134.25 45.09 2.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 73.4 110.872 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.447 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -131.99 -68.44 0.63 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 71.45 110.865 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.35 -47.0 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.798 -0.715 . . . . 64.21 112.541 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.457 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.15 39.83 1.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.813 0.34 . . . . 74.32 110.852 -179.867 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.8 tttm -52.96 117.92 3.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 73.32 110.904 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.504 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.8 t -131.41 93.98 3.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 73.42 111.139 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.657 HG11 ' HB2' ' A' ' 17' ' ' ASP . 42.0 t -77.78 126.05 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.441 . . . . 73.31 111.147 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.722 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.3 OUTLIER -84.28 52.42 2.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.153 -0.476 . . . . 62.31 110.966 -179.989 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -39.19 106.92 0.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 71.22 110.901 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.88 45.6 0.37 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.698 -0.763 . . . . 72.21 112.437 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.57 HD11 ' HB3' ' A' ' 29' ' ' LEU . 14.3 mm -106.66 90.35 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.829 0.347 . . . . 61.5 111.118 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.54 158.57 34.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 61.35 110.888 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 164.42 -106.58 0.28 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.782 -0.723 . . . . 52.54 112.513 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.759 HD12 ' HB ' ' A' ' 44' ' ' ILE . 47.7 mt -156.63 82.65 0.96 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.839 0.352 . . . . 71.4 110.926 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.474 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -165.66 169.03 15.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.454 . . . . 74.14 110.932 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -176.6 -35.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 73.4 110.927 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -123.52 -45.94 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 53.44 111.071 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -95.33 176.44 6.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.128 -0.487 . . . . 71.53 110.844 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.4 p -148.54 30.71 0.82 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.19 -0.459 . . . . 74.13 110.885 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -105.14 -76.32 0.61 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 54.2 110.9 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -78.28 60.27 2.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 65.02 110.869 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.2 p -84.23 157.82 21.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 74.12 110.879 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.759 ' HB ' HD12 ' A' ' 35' ' ' LEU . 24.8 mm -143.81 140.91 25.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 74.12 111.139 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.7 mtt -143.8 145.43 32.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.066 -0.516 . . . . 73.23 110.857 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 41.7 m-20 -91.52 -169.97 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 64.13 110.83 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.69 -60.73 3.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 53.33 110.892 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -51.19 -57.41 8.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 74.32 110.908 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.02 -57.92 7.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.11 -0.496 . . . . 70.33 110.915 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.0 t -53.46 -42.17 66.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.124 -0.489 . . . . 71.31 110.853 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -57.6 -44.67 85.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 72.14 110.878 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.76 -61.51 2.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 63.45 111.155 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.494 ' O ' HG13 ' A' ' 57' ' ' VAL . 15.3 t80 -52.32 -47.29 66.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 75.51 110.848 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.426 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.2 -49.6 73.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 72.25 110.835 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.44 -42.27 61.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.256 -0.429 . . . . 62.54 111.127 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.717 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.5 mt-30 -69.96 -66.67 0.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 50.13 110.886 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.494 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.0 m -47.45 -35.63 4.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.434 . . . . 74.13 111.167 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -69.04 -54.58 14.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 73.22 110.857 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.7 -54.35 19.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 72.22 111.105 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.551 ' O ' HG13 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -61.79 -48.91 78.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 72.14 110.928 -179.941 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.47 -39.44 33.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 72.02 110.839 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.52 -54.33 12.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 75.13 111.096 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.24 -31.39 63.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 54.3 110.826 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.551 HG13 ' O ' ' A' ' 60' ' ' PHE . 11.2 m -88.18 -22.51 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 72.4 111.175 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -51.68 -26.27 8.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 74.22 110.859 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -75.65 -38.01 59.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 75.05 111.094 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 49.78 -168.21 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 75.41 110.807 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 54.9 m -155.72 -77.03 0.1 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.055 -0.521 . . . . 74.54 111.127 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.444 HG21 HG23 ' A' ' 114' ' ' ILE . 0.9 OUTLIER -151.17 144.66 16.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 73.32 111.091 179.974 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.414 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -78.99 155.63 77.43 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.621 0.724 . . . . 43.12 111.107 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.648 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.9 Cg_endo -69.62 -6.93 19.72 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.736 2.29 . . . . 72.52 112.347 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.17 -36.69 9.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 71.53 110.917 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.583 ' O ' HG23 ' A' ' 77' ' ' VAL . 21.7 t80 -59.06 -61.72 2.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.495 . . . . 71.33 110.856 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.844 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -39.43 -69.62 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 74.21 111.134 179.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.418 HG23 ' N ' ' A' ' 76' ' ' LYS . 35.7 m -49.54 -40.01 14.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.093 -0.503 . . . . 71.12 111.168 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.418 ' N ' HG23 ' A' ' 75' ' ' VAL . 25.2 mtmt -60.92 -45.12 95.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 74.41 110.933 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 73' ' ' PHE . 21.9 t -60.83 -39.79 83.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.146 -0.479 . . . . 74.5 111.086 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.464 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -63.98 -59.55 4.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 54.24 110.909 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt -63.05 -22.85 67.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 74.11 110.895 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -68.92 -52.95 24.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 71.23 110.84 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.693 HD22 ' HB3' ' A' ' 124' ' ' PRO . 11.7 mt -91.12 13.1 17.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.245 -0.434 . . . . 64.35 110.906 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.2 m 55.35 38.34 30.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.447 . . . . 54.04 110.837 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.686 HD21 HD13 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -79.54 86.67 5.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 70.21 110.92 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.637 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.53 157.23 0.15 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.482 . . . . 63.52 111.124 179.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -56.26 -21.74 25.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 75.24 110.911 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -81.97 -48.85 10.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.206 -0.452 . . . . 73.01 110.959 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.637 ' H ' HG23 ' A' ' 84' ' ' THR . 5.5 tp10 -61.89 -56.88 14.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 64.1 110.886 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.405 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -51.78 -38.04 53.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.169 -0.469 . . . . 73.15 111.099 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 27.0 t -77.69 -26.75 50.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 62.4 110.797 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -80.85 -29.21 35.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 63.23 110.868 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.768 HD12 ' HB3' ' A' ' 131' ' ' ARG . 18.2 mm -99.8 -60.95 2.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 61.13 111.106 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.608 ' HB3' HG23 ' A' ' 113' ' ' THR . 7.3 m-85 -72.69 -60.74 2.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 75.43 110.851 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 108.72 46.36 0.97 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.734 -0.746 . . . . 44.31 112.487 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -75.55 -43.78 23.15 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.722 -0.751 . . . . 41.52 112.562 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.412 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 108.34 167.9 21.19 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.77 -0.729 . . . . 71.53 112.502 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.491 HG13 ' N ' ' A' ' 97' ' ' ASN . 3.1 p -52.33 -50.02 39.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.794 0.33 . . . . 62.22 111.172 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.491 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.9 OUTLIER -86.66 37.61 0.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.115 -0.493 . . . . 71.14 110.862 179.951 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.412 ' HB2' ' O ' ' A' ' 95' ' ' GLY . . . -64.6 -75.82 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.449 . . . . 55.14 111.044 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -44.42 -40.46 5.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.259 -0.428 . . . . 75.24 110.857 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.2 m -59.68 -74.76 0.07 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 74.31 110.838 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.617 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 16.3 mtt85 -50.19 -45.77 53.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.075 -0.511 . . . . 64.23 110.85 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.733 ' HB3' HD12 ' A' ' 74' ' ' ILE . 10.5 m-85 -56.09 -36.36 68.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.221 -0.445 . . . . 64.35 110.89 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -51.45 -29.23 15.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.473 . . . . 74.53 110.92 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -108.55 -23.02 12.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 61.22 110.921 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.09 26.54 8.8 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.723 -0.751 . . . . 73.05 112.438 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -96.99 -4.85 39.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.805 0.336 . . . . 71.23 110.888 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.617 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -112.58 8.4 19.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.216 -0.447 . . . . 22.02 111.144 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.515 ' HB2' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -125.2 57.1 15.42 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.577 0.703 . . . . 71.14 110.87 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.54 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.2 Cg_endo -69.82 35.88 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.679 2.253 . . . . 64.45 112.279 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.786 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 1.1 t-80 74.79 31.28 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.644 0.735 . . . . 74.34 110.887 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.786 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.9 Cg_endo -69.78 -163.78 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.707 2.272 . . . . 74.13 112.306 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.14 -29.78 24.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.17 -0.468 . . . . 63.14 110.84 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.608 HG23 ' HB3' ' A' ' 92' ' ' PHE . 21.9 m -53.06 -52.18 59.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 73.42 111.134 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.515 HD11 ' HB2' ' A' ' 108' ' ' GLN . 38.8 mm -51.11 -45.14 30.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 62.53 111.183 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.449 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -65.35 -28.46 69.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 73.22 110.917 179.796 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.519 ' O ' HD23 ' A' ' 120' ' ' LEU . 5.9 mp -79.53 -42.92 24.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 74.04 110.905 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.844 HD13 HG22 ' A' ' 74' ' ' ILE . 7.3 mt -62.03 -47.64 83.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 65.23 110.898 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.587 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.3 ptp180 -54.74 -34.29 62.29 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.192 -0.458 . . . . 60.54 110.903 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.591 HG23 HD23 ' A' ' 126' ' ' LEU . 32.1 m -94.59 -10.13 9.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.164 -0.471 . . . . 73.22 111.083 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.759 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.6 OUTLIER -82.57 -40.19 21.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.197 -0.456 . . . . 72.21 110.924 179.907 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -49.54 -32.79 13.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.207 -0.452 . . . . 72.41 110.882 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.52 -21.13 19.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 73.22 110.905 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.759 ' O ' HD13 ' A' ' 120' ' ' LEU . 66.5 m-70 -129.83 90.26 43.61 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.58 0.705 . . . . 61.53 110.911 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.693 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.6 Cg_endo -69.71 -0.72 7.28 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.674 2.25 . . . . 63.34 112.358 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -112.2 -12.39 13.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 74.54 110.792 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.689 ' O ' HG23 ' A' ' 130' ' ' ILE . 6.5 tp -53.79 -47.84 70.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.259 -0.428 . . . . 71.22 110.908 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.686 HD13 HD21 ' A' ' 83' ' ' LEU . 2.2 pt? -51.27 -28.67 12.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.212 -0.449 . . . . 64.0 110.905 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.488 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.87 -26.13 24.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 73.41 110.861 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.409 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.0 OUTLIER -95.78 2.99 54.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 71.44 110.912 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.689 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.1 pt -121.79 -34.55 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.138 -0.483 . . . . 75.14 111.117 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.768 ' HB3' HD12 ' A' ' 91' ' ' ILE . 1.7 ptt-85 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.14 -0.482 . . . . 65.42 110.851 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.603 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 6.2 mmt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.827 0.346 . . . . 71.03 110.818 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.65 -170.36 0.48 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 75.44 110.898 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.7 p 177.67 57.54 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.551 0.691 . . . . 43.34 110.92 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 3.58 2.66 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.672 2.248 . . . . 71.42 112.302 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 4.9 m -96.38 -42.69 12.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.289 -0.414 . . . . 73.21 111.172 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -120.54 -33.03 3.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.475 . . . . 61.32 110.922 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 65.29 51.46 1.59 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 72.33 110.906 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 95.5 mm-40 -118.2 -75.42 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 75.22 110.949 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.51 -115.63 2.96 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.688 -0.768 . . . . 52.11 112.475 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.603 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 6.3 pt-20 -174.88 95.38 0.08 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.837 0.351 . . . . 70.42 110.843 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.537 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.2 ptp -54.71 105.99 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.492 . . . . 75.52 110.847 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.4 HG12 ' O ' ' A' ' 10' ' ' GLU . 7.1 p -148.57 129.12 4.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 64.13 111.106 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.536 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -45.22 128.55 7.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.123 -0.49 . . . . 73.31 110.892 -179.87 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.401 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 179.88 80.0 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.791 -0.718 . . . . 74.04 112.509 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.402 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -36.8 145.9 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.876 0.369 . . . . 74.44 111.126 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.23 -167.9 2.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.183 -0.462 . . . . 73.34 110.933 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -94.39 116.18 28.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 75.12 110.861 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.757 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.3 mm -108.03 90.87 7.07 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.594 0.711 . . . . 71.03 111.128 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.49 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 53.0 Cg_endo -69.83 104.07 1.27 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.706 2.27 . . . . 61.1 112.286 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -71.49 -28.47 63.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.16 -0.473 . . . . 63.41 110.889 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.531 HG21 ' HG2' ' A' ' 25' ' ' ARG . 27.4 m -131.31 149.42 52.57 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.059 -0.519 . . . . 61.12 111.14 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.83 41.18 0.76 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.232 -0.44 . . . . 73.4 110.907 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -129.83 -48.45 1.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 71.45 110.927 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -146.34 -49.43 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.743 -0.741 . . . . 64.21 112.533 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.531 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -103.22 46.34 0.92 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.834 0.35 . . . . 74.32 110.797 -179.834 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.434 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 11.3 tttt -49.52 112.14 0.6 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.263 -0.426 . . . . 73.32 110.884 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.507 HG21 ' CG ' ' A' ' 60' ' ' PHE . 2.3 t -132.81 96.11 3.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.242 -0.436 . . . . 73.42 111.182 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.49 ' HA ' ' HA ' ' A' ' 19' ' ' PRO . 0.7 OUTLIER -84.65 140.34 16.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 73.31 111.164 179.928 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.757 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -86.58 63.7 8.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 62.31 110.929 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -42.36 104.39 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 71.22 110.913 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.49 ' O ' HD13 ' A' ' 32' ' ' ILE . . . 117.53 60.47 0.3 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.706 -0.759 . . . . 72.21 112.554 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.589 HD11 ' CB ' ' A' ' 29' ' ' LEU . 18.2 mm -116.63 93.05 2.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.856 0.36 . . . . 61.5 111.117 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.43 157.38 34.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 61.35 110.932 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 163.48 -106.77 0.28 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.769 -0.729 . . . . 52.54 112.533 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.747 HD12 ' HB ' ' A' ' 44' ' ' ILE . 49.6 mt -156.53 83.44 0.97 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.886 0.374 . . . . 71.4 110.966 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.57 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -167.64 169.5 11.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 74.14 110.994 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -178.88 -34.77 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.199 -0.455 . . . . 73.4 110.927 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.5 m -122.28 -44.99 2.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 53.44 111.138 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -98.53 177.45 5.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 71.53 110.862 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 29.0 p -148.47 26.51 0.94 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.209 -0.45 . . . . 74.13 110.911 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.8 mp0 -100.66 -76.75 0.55 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.138 -0.483 . . . . 54.2 110.859 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -78.38 59.54 2.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.076 -0.511 . . . . 65.02 110.923 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.2 p -84.39 159.25 20.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.072 -0.513 . . . . 74.12 110.82 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.747 ' HB ' HD12 ' A' ' 35' ' ' LEU . 28.2 mm -142.81 140.61 27.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.082 -0.508 . . . . 74.12 111.103 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.0 mtm -145.4 135.11 23.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 73.23 110.928 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -81.53 -170.08 2.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.294 -0.412 . . . . 64.13 110.879 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.34 -58.96 5.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 53.33 110.922 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -52.73 -56.99 11.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 74.32 110.843 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.75 -59.28 4.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 70.33 110.912 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.8 t -53.31 -38.27 63.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 71.31 110.864 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.69 -43.71 98.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 72.14 110.838 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.08 -57.5 8.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 63.45 111.008 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -55.01 -47.3 74.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.256 -0.429 . . . . 75.51 110.84 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.413 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.95 -48.87 74.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.213 -0.449 . . . . 72.25 110.916 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.97 -41.75 64.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 62.54 111.084 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.749 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.4 mt-30 -69.52 -66.35 0.6 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 50.13 110.904 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.479 HG23 ' N ' ' A' ' 58' ' ' LYS . 27.2 m -47.4 -42.52 7.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 74.13 111.074 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.479 ' N ' HG23 ' A' ' 57' ' ' VAL . 3.7 mmtp -64.03 -50.76 67.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 73.22 110.836 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.53 -50.71 52.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 72.22 111.099 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.507 ' CG ' HG21 ' A' ' 27' ' ' THR . 0.3 OUTLIER -67.82 -43.95 78.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.233 -0.439 . . . . 72.14 110.924 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 36.5 mtp85 -51.04 -43.95 61.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 72.02 110.895 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.33 -55.42 8.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 75.13 111.097 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.83 -37.93 53.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 54.3 110.839 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.41 HG12 ' O ' ' A' ' 60' ' ' PHE . 5.2 p -84.86 -22.82 7.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 72.4 111.093 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.84 -23.99 55.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 74.22 110.9 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.42 -25.66 50.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 75.05 111.095 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -63.78 -169.83 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 75.41 110.846 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 54.1 m -134.96 -76.94 0.45 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 74.54 111.124 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.511 HG11 HG23 ' A' ' 74' ' ' ILE . 0.9 OUTLIER -150.14 143.56 17.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 73.32 111.123 179.949 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.602 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -82.27 160.81 61.71 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.55 0.691 . . . . 43.12 111.071 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.602 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.4 Cg_endo -69.75 -7.63 21.55 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.632 2.222 . . . . 72.52 112.413 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -101.16 -36.28 9.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 71.53 110.919 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -56.6 -61.4 2.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 71.33 110.922 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.783 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.33 -68.7 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 74.21 111.089 179.944 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 28.1 m -48.53 -39.23 10.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 71.12 111.143 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.1 mtmt -60.68 -39.59 88.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 74.41 110.872 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.53 HG22 ' HB2' ' A' ' 121' ' ' ASP . 90.2 t -70.14 -36.91 70.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.189 -0.459 . . . . 74.5 111.126 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.3 OUTLIER -69.96 -34.27 73.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.192 -0.458 . . . . 54.24 110.917 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.7 ptpt -88.73 -19.78 25.65 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.181 -0.463 . . . . 74.11 110.861 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.469 ' HG2' HD23 ' A' ' 81' ' ' LEU . 3.1 ttmt -75.85 -50.63 14.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.258 -0.428 . . . . 71.23 110.87 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.824 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.1 mt -91.27 13.14 18.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.274 -0.421 . . . . 64.35 110.932 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 7.5 t 52.22 41.18 30.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 54.04 110.857 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.824 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.6 mm? -79.48 85.0 5.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 70.21 110.913 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.598 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -46.84 155.99 0.23 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 63.52 111.143 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -59.1 -20.62 55.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 75.24 110.902 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.01 -53.57 6.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 73.01 110.922 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.598 ' H ' HG23 ' A' ' 84' ' ' THR . 0.6 OUTLIER -65.9 -53.79 34.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 64.1 110.885 179.953 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.481 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -51.49 -31.87 25.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 73.15 111.046 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 44.4 t -80.24 -39.95 28.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.266 -0.425 . . . . 62.4 110.795 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -71.69 -20.89 61.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.473 . . . . 63.23 110.861 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.711 ' CD1' HD12 ' A' ' 127' ' ' LEU . 53.3 mt -104.31 -64.05 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 61.13 111.098 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.535 ' HB3' HG23 ' A' ' 113' ' ' THR . 8.7 m-85 -74.58 -61.15 1.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 75.43 110.834 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 113.09 47.96 0.63 Allowed Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.7 -0.762 . . . . 44.31 112.494 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.631 ' C ' ' HB2' ' A' ' 98' ' ' ALA . . . -68.04 -38.46 88.48 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.753 -0.737 . . . . 41.52 112.472 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 98.72 -164.94 20.98 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.768 -0.73 . . . . 71.53 112.489 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 5.2 t -71.41 -70.71 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.805 0.336 . . . . 62.22 111.107 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 26.1 t30 -84.87 39.41 0.75 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 71.14 110.847 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.631 ' HB2' ' C ' ' A' ' 94' ' ' GLY . . . -61.54 -71.69 0.14 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 55.14 111.016 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -41.15 -42.74 2.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 75.24 110.872 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.44 -74.72 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.162 -0.472 . . . . 74.31 110.86 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.606 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 10.0 mtt180 -48.27 -49.45 33.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.095 -0.502 . . . . 64.23 110.924 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.536 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.4 m-85 -53.8 -37.23 63.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 64.35 110.901 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -53.36 -34.65 58.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.135 -0.484 . . . . 74.53 110.88 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.61 -19.83 16.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 61.22 110.9 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.08 26.74 11.9 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.775 -0.726 . . . . 73.05 112.444 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -98.82 -6.16 29.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.882 0.372 . . . . 71.23 110.898 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.606 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -117.44 17.58 14.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.479 . . . . 22.02 111.099 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.429 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 0.0 OUTLIER -126.48 55.31 13.54 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.552 0.692 . . . . 71.14 110.944 -179.929 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.497 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.0 Cg_endo -69.8 38.5 0.26 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.667 2.245 . . . . 64.45 112.37 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.732 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.7 t60 71.63 34.9 0.08 OUTLIER Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 121.604 0.716 . . . . 74.34 110.88 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.732 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.1 Cg_endo -69.82 -163.88 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.184 0 C-N-CA 122.714 2.276 . . . . 74.13 112.319 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 83.9 p -86.82 -29.56 22.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 63.14 110.889 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.535 HG23 ' HB3' ' A' ' 92' ' ' PHE . 18.8 m -56.25 -47.19 79.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.09 -0.505 . . . . 73.42 111.114 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.43 HG23 HG21 ' A' ' 69' ' ' VAL . 47.5 mm -56.29 -44.83 80.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 62.53 111.182 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.417 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -66.74 -28.97 68.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.108 -0.496 . . . . 73.22 110.892 179.845 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.52 ' CD2' HD12 ' A' ' 130' ' ' ILE . 5.6 mp -79.36 -42.12 26.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.259 -0.428 . . . . 74.04 110.945 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.783 HD13 HG22 ' A' ' 74' ' ' ILE . 19.3 mt -63.57 -48.84 75.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.241 -0.436 . . . . 65.23 110.917 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.593 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.3 ptp180 -52.61 -35.4 54.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 60.54 110.889 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.593 HG13 ' HG3' ' A' ' 118' ' ' ARG . 28.8 m -93.09 -13.36 8.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 73.22 111.11 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.747 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -78.05 -40.23 39.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 72.21 110.899 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.53 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.6 OUTLIER -49.95 -30.91 11.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.124 -0.489 . . . . 72.41 110.88 179.848 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.7 -20.3 17.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 73.22 110.895 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.747 ' O ' HD13 ' A' ' 120' ' ' LEU . 40.6 m-70 -127.98 87.73 54.89 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.557 0.694 . . . . 61.53 110.826 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.568 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.9 Cg_endo -69.78 3.42 2.79 Favored 'Trans proline' 0 N--CA 1.465 -0.174 0 C-N-CA 122.686 2.258 . . . . 63.34 112.384 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -117.19 -12.75 10.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 74.54 110.859 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.666 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.3 tp -53.95 -46.91 71.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 71.22 110.919 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.711 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.48 -29.64 6.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.476 . . . . 64.0 110.872 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.5 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.42 -28.37 23.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 73.41 110.891 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.423 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -93.29 4.36 54.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.185 -0.461 . . . . 71.44 110.855 179.996 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.666 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.0 pt -123.24 -35.03 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 75.14 111.163 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.5 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.8 ptt-85 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.481 . . . . 65.42 110.89 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 mmt . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.882 0.373 . . . . 71.03 110.874 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.35 -169.64 0.46 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.446 . . . . 75.44 110.92 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.419 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 1.7 p 178.78 55.74 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.592 0.71 . . . . 43.34 110.891 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 53.5 Cg_endo -69.77 -8.64 24.12 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.674 2.249 . . . . 71.42 112.346 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.664 HG21 ' CD ' ' A' ' 42' ' ' GLU . 6.8 m -67.49 -49.48 70.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.198 -0.455 . . . . 73.21 111.082 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.455 ' N ' HG23 ' A' ' 5' ' ' VAL . 1.2 m -133.3 -20.98 2.08 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.187 -0.461 . . . . 61.32 110.933 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 66.58 89.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 72.33 110.874 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.637 HE21 ' N ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -132.14 -65.89 0.72 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 75.22 110.94 -179.903 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.524 ' HA3' HG13 ' A' ' 38' ' ' VAL . . . -129.54 -95.4 0.77 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.739 -0.744 . . . . 52.11 112.464 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.586 ' HG2' HG12 ' A' ' 38' ' ' VAL . 7.1 pt-20 -177.67 95.3 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.805 0.336 . . . . 70.42 110.866 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.567 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -62.27 102.65 0.32 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 75.52 110.851 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.9 p -143.88 128.52 14.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 64.13 111.114 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.627 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -48.42 129.63 16.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 73.31 110.861 -179.829 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.404 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 178.05 81.15 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.74 -0.743 . . . . 74.04 112.545 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.408 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -36.8 146.22 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.843 0.354 . . . . 74.44 111.13 -179.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.32 -165.48 1.59 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.138 -0.483 . . . . 73.34 110.912 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.674 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.7 OUTLIER -94.24 118.21 31.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.305 -0.407 . . . . 75.12 110.92 179.85 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.746 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.1 mm -109.87 90.99 10.02 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.593 0.711 . . . . 71.03 111.158 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.455 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.2 Cg_endo -69.84 96.29 0.59 Allowed 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.704 2.269 . . . . 61.1 112.26 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -63.18 -36.44 83.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 63.41 110.964 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.534 HG21 ' HG2' ' A' ' 25' ' ' ARG . 58.8 m -129.33 151.43 49.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.109 -0.496 . . . . 61.12 111.117 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -146.1 40.37 1.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 73.4 110.869 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.461 ' H ' HG22 ' A' ' 21' ' ' THR . 5.7 mtt85 -125.21 -57.37 1.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 71.45 110.856 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -145.52 -39.21 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.803 -0.713 . . . . 64.21 112.501 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.534 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -105.19 40.8 1.45 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.826 0.346 . . . . 74.32 110.863 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.472 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 0.7 OUTLIER -51.03 115.16 1.4 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 73.32 110.9 179.924 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 27' ' ' THR . 1.8 t -128.98 94.87 3.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.254 -0.43 . . . . 73.42 111.154 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.674 HG11 ' HB2' ' A' ' 17' ' ' ASP . 48.3 t -78.3 127.61 38.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 73.31 111.13 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.746 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.3 OUTLIER -84.39 51.68 2.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.124 -0.489 . . . . 62.31 110.852 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 29' ' ' LEU . 35.5 mttp -37.4 107.51 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.256 -0.429 . . . . 71.22 110.871 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.19 48.11 0.4 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.743 -0.741 . . . . 72.21 112.506 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.6 HD11 ' HB3' ' A' ' 29' ' ' LEU . 18.7 mm -108.07 92.38 2.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.842 0.353 . . . . 61.5 111.181 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.8 153.52 38.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 61.35 110.863 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.64 -108.62 0.31 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.774 -0.727 . . . . 52.54 112.459 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.753 HD12 ' HB ' ' A' ' 44' ' ' ILE . 48.8 mt -156.74 86.24 0.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.879 0.371 . . . . 71.4 110.898 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.44 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.83 162.79 32.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 74.14 110.858 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.0 t -164.7 -39.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.082 -0.508 . . . . 73.4 110.924 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.586 HG12 ' HG2' ' A' ' 10' ' ' GLU . 5.5 p -129.86 -44.13 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 53.44 111.123 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.439 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -90.79 169.81 10.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.203 -0.453 . . . . 71.53 110.784 179.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.2 p -134.92 6.92 3.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.485 . . . . 74.13 110.931 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -93.73 -65.3 1.0 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.474 . . . . 54.2 110.904 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.664 ' CD ' HG21 ' A' ' 5' ' ' VAL . 16.1 tp10 -75.95 61.4 1.49 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 65.02 110.902 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.9 p -100.64 158.59 15.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 74.12 110.835 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.753 ' HB ' HD12 ' A' ' 35' ' ' LEU . 20.8 mm -142.81 140.01 27.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.149 -0.478 . . . . 74.12 111.114 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.7 mtt -143.75 133.88 24.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 73.23 110.889 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.3 m-20 -86.19 -169.87 2.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 64.13 110.869 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.87 -59.12 5.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 53.33 110.909 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -53.79 -56.53 16.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 74.32 110.926 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.29 -59.56 4.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.074 -0.512 . . . . 70.33 110.944 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.5 t -54.17 -39.38 66.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.486 . . . . 71.31 110.867 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.8 -45.47 89.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.128 -0.487 . . . . 72.14 110.857 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.81 -58.96 4.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.193 -0.458 . . . . 63.45 111.137 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.464 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.1 t80 -53.99 -47.8 71.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.189 -0.46 . . . . 75.51 110.899 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.408 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.28 -48.77 76.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.131 -0.486 . . . . 72.25 110.901 179.946 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.25 -41.77 63.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 62.54 111.05 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.741 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.7 mt-30 -70.19 -66.62 0.57 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 50.13 110.886 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.464 HG13 ' O ' ' A' ' 53' ' ' PHE . 13.5 m -47.32 -35.3 3.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 74.13 111.164 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.3 mmmt -70.29 -52.35 23.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 73.22 110.888 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.48 -50.77 59.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.251 -0.431 . . . . 72.22 111.138 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.65 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -65.14 -47.63 76.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.438 . . . . 72.14 110.834 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.11 -51.75 40.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.132 -0.485 . . . . 72.02 110.895 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.78 -54.76 34.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 75.13 111.08 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.19 -42.53 40.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 54.3 110.796 -179.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 60' ' ' PHE . 37.5 t -76.56 -27.32 17.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.435 . . . . 72.4 111.143 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.91 -19.45 60.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 74.22 110.916 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.35 -21.97 64.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.47 . . . . 75.05 111.055 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -54.62 -75.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 75.41 110.922 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.755 HG22 HG13 ' A' ' 69' ' ' VAL . 93.6 m -134.42 -75.97 0.47 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.159 -0.473 . . . . 74.54 111.176 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.755 HG13 HG22 ' A' ' 68' ' ' THR . 17.2 m -149.55 -172.95 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 73.32 111.126 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.464 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -106.3 156.93 36.08 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.589 0.709 . . . . 43.12 111.131 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.48 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.3 Cg_endo -69.83 -7.95 22.38 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.699 2.266 . . . . 72.52 112.314 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.32 -34.68 10.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.446 . . . . 71.53 110.822 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.404 ' CE1' ' HA ' ' A' ' 118' ' ' ARG . 12.9 t80 -58.93 -61.15 2.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 71.33 110.864 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.841 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -43.91 -66.39 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.21 111.145 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.1 m -50.95 -38.64 18.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 71.12 111.068 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt -59.54 -47.8 84.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 74.41 110.912 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.5 t -60.78 -39.54 82.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.152 -0.476 . . . . 74.5 111.094 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.2 OUTLIER -62.14 -58.77 6.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 54.24 110.86 -179.936 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -19.97 65.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 74.11 110.865 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.3 ttmm -69.33 -55.83 9.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 71.23 110.853 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.716 HD13 HD12 ' A' ' 120' ' ' LEU . 7.1 mt -91.39 15.12 12.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.267 -0.424 . . . . 64.35 110.914 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 53.4 39.26 29.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 54.04 110.832 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.701 HD22 ' CE2' ' A' ' 92' ' ' PHE . 0.4 OUTLIER -79.84 87.09 5.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.137 -0.483 . . . . 70.21 110.921 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.598 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.39 156.74 0.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.162 -0.472 . . . . 63.52 111.178 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -58.78 -21.47 55.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 75.24 110.902 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.47 -54.19 6.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 73.01 110.917 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.598 ' H ' HG23 ' A' ' 84' ' ' THR . 0.7 OUTLIER -61.48 -53.15 60.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 64.1 110.921 179.897 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.42 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -51.57 -32.46 28.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.083 -0.508 . . . . 73.15 111.077 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 4.3 m -80.72 -34.44 34.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.296 -0.411 . . . . 62.4 110.856 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -76.26 -21.61 56.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.101 -0.499 . . . . 63.23 110.868 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.742 ' CD1' HD12 ' A' ' 127' ' ' LEU . 40.6 mt -105.65 -62.22 2.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.446 . . . . 61.13 111.113 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.701 ' CE2' HD22 ' A' ' 83' ' ' LEU . 5.4 m-85 -75.69 -63.22 1.35 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 75.43 110.897 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 115.54 48.72 0.5 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.736 -0.745 . . . . 44.31 112.516 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -70.37 -37.06 70.15 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.738 -0.744 . . . . 41.52 112.453 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 103.87 -160.0 16.37 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.743 -0.742 . . . . 71.53 112.464 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.8 t -76.7 -69.93 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.927 0.394 . . . . 62.22 111.14 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -85.37 44.09 1.07 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.467 . . . . 71.14 110.893 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -59.05 -75.58 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 55.14 111.09 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.403 ' C ' ' O ' ' A' ' 98' ' ' ALA . 36.6 m-85 -37.75 -43.26 0.64 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.216 -0.447 . . . . 75.24 110.924 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.2 t -58.31 -75.86 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 74.31 110.859 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.617 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 20.9 mtt180 -49.45 -49.24 46.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 64.23 110.851 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.595 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.4 m-85 -53.0 -36.21 60.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 64.35 110.916 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -52.72 -36.29 57.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 74.53 110.856 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.79 -19.6 16.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 61.22 110.903 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.78 24.46 13.35 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.768 -0.73 . . . . 73.05 112.507 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -95.58 -5.78 41.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.803 0.335 . . . . 71.23 110.876 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.617 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -115.02 17.43 16.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 22.02 111.133 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.566 ' HB2' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -129.49 56.03 21.86 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.603 0.716 . . . . 71.14 110.889 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.514 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.6 Cg_endo -69.75 38.67 0.26 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.734 2.289 . . . . 64.45 112.339 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.745 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER 72.05 34.21 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.547 0.689 . . . . 74.34 110.849 179.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.745 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.1 Cg_endo -69.81 -164.5 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.632 2.222 . . . . 74.13 112.34 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 4.1 p -88.94 -27.15 21.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.138 -0.483 . . . . 63.14 110.932 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.569 HG23 ' HB3' ' A' ' 92' ' ' PHE . 8.3 m -56.94 -49.85 74.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.058 -0.519 . . . . 73.42 111.121 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.566 HD11 ' HB2' ' A' ' 108' ' ' GLN . 36.5 mm -47.5 -45.75 10.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 62.53 111.169 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.708 ' HD3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -65.39 -46.98 77.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.475 . . . . 73.22 110.818 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.708 HD12 ' HD3' ' A' ' 115' ' ' LYS . 7.8 mp -60.16 -34.15 73.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.273 -0.421 . . . . 74.04 111.002 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.841 HD13 HG22 ' A' ' 74' ' ' ILE . 25.4 mt -69.69 -56.79 6.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 65.23 110.907 179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.47 ' HG3' HG13 ' A' ' 119' ' ' VAL . 11.5 ptp180 -51.0 -34.09 27.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.152 -0.476 . . . . 60.54 110.911 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.518 HG23 HD23 ' A' ' 126' ' ' LEU . 18.6 m -87.71 -20.31 7.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.155 -0.475 . . . . 73.22 111.136 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.754 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -75.21 -40.51 59.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.136 -0.484 . . . . 72.21 110.891 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -49.89 -31.42 12.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 72.41 110.825 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -94.99 -21.21 18.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 73.22 110.937 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.754 ' O ' HD13 ' A' ' 120' ' ' LEU . 91.7 m-70 -131.37 91.69 34.3 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.626 0.727 . . . . 61.53 110.846 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.621 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.8 Cg_endo -69.77 0.7 5.28 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.699 2.266 . . . . 63.34 112.316 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -114.45 -13.02 12.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.208 -0.451 . . . . 74.54 110.9 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.518 HD23 HG23 ' A' ' 119' ' ' VAL . 6.3 tp -53.06 -49.28 66.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.143 -0.481 . . . . 71.22 110.913 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.742 HD12 ' CD1' ' A' ' 91' ' ' ILE . 2.6 pt? -46.65 -32.55 3.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 64.0 110.956 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.39 -38.44 26.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 73.41 110.929 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.582 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.7 OUTLIER -78.09 -7.59 57.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 71.44 110.891 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.582 HG23 ' HG3' ' A' ' 129' ' ' GLU . 7.1 pt -118.73 -17.03 7.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.164 -0.471 . . . . 75.14 111.122 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 65.42 110.903 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.81 0.338 . . . . 71.03 110.858 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.495 ' O ' ' HB2' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -174.69 -170.6 0.5 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 75.44 110.864 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 49.6 t 176.11 59.49 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.613 0.72 . . . . 43.34 110.867 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 1.04 4.82 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.638 2.225 . . . . 71.42 112.328 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.469 HG23 ' N ' ' A' ' 6' ' ' CYS . 34.1 m -87.84 -42.63 15.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 73.21 111.136 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.469 ' N ' HG23 ' A' ' 5' ' ' VAL . 1.2 t -126.97 -24.33 3.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 61.32 110.918 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.432 ' N ' ' O ' ' A' ' 3' ' ' CYS . 16.2 m-70 62.92 47.67 4.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 72.33 110.785 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -102.25 -75.26 0.6 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 75.22 110.914 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -110.77 -137.95 7.63 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.694 -0.765 . . . . 52.11 112.56 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -144.54 104.48 4.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.85 0.357 . . . . 70.42 110.877 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.558 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -67.43 107.25 2.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 75.52 110.914 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -146.97 130.89 9.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 64.13 111.121 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.563 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -47.99 132.24 15.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 73.31 110.895 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.41 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 177.18 79.69 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.751 -0.738 . . . . 74.04 112.514 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.41 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.88 146.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.913 0.387 . . . . 74.44 111.095 -179.941 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.09 -165.72 1.67 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 73.34 110.913 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.697 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -94.88 116.73 29.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.241 -0.436 . . . . 75.12 110.91 179.843 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.746 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.0 mm -107.93 90.74 6.81 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.616 0.722 . . . . 71.03 111.138 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.481 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.73 96.12 0.58 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.706 2.271 . . . . 61.1 112.332 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.0 t80 -64.58 -35.96 82.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 63.41 110.84 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.492 HG21 ' HG2' ' A' ' 25' ' ' ARG . 20.2 m -131.35 152.35 50.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.457 . . . . 61.12 111.16 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -155.29 37.64 0.39 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.257 -0.429 . . . . 73.4 110.935 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.38 -34.0 1.86 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.157 -0.474 . . . . 71.45 110.89 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -156.91 -51.0 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.741 -0.742 . . . . 64.21 112.468 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.492 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -107.71 53.14 0.7 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.859 0.361 . . . . 74.32 110.883 -179.859 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.408 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 19.4 tttt -56.73 121.11 9.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.487 . . . . 73.32 110.909 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.414 ' O ' HG23 ' A' ' 27' ' ' THR . 1.8 t -136.8 92.95 2.79 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.288 -0.415 . . . . 73.42 111.144 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.697 HG11 ' HB2' ' A' ' 17' ' ' ASP . 45.8 t -77.3 128.12 38.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 73.31 111.151 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.752 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.67 51.88 2.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.188 -0.46 . . . . 62.31 110.908 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.401 ' C ' ' O ' ' A' ' 29' ' ' LEU . 30.5 mttp -37.25 107.24 0.06 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 71.22 110.903 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 117.7 50.03 0.37 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.797 -0.716 . . . . 72.21 112.526 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.594 HD11 ' HB3' ' A' ' 29' ' ' LEU . 19.1 mm -109.46 92.65 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.894 0.378 . . . . 61.5 111.18 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.42 154.0 37.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 61.35 110.843 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.64 -108.46 0.31 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.78 -0.724 . . . . 52.54 112.497 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.755 HD12 ' HB ' ' A' ' 44' ' ' ILE . 61.0 mt -156.67 86.16 0.99 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.85 0.357 . . . . 71.4 110.986 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.445 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -161.45 164.3 29.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.15 -0.477 . . . . 74.14 110.923 -179.931 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 9.9 t -169.29 -44.33 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 73.4 110.835 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.0 m -120.69 -47.41 2.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 53.44 111.148 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.88 172.71 8.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 71.53 110.895 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.8 t -138.15 9.86 2.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.425 . . . . 74.13 110.951 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -97.91 -63.31 1.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 54.2 110.929 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -76.66 60.59 1.7 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.14 -0.482 . . . . 65.02 110.933 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.9 p -98.3 158.65 15.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 74.12 110.854 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.755 ' HB ' HD12 ' A' ' 35' ' ' LEU . 18.3 mm -144.31 139.39 24.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 74.12 111.169 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.8 mtt -142.06 137.51 31.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.192 -0.458 . . . . 73.23 110.975 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 40.9 m-20 -89.05 -169.52 2.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 64.13 110.887 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? -54.78 -59.8 4.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 53.33 110.857 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -56.84 13.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 74.32 110.905 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.02 -59.43 4.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.105 -0.498 . . . . 70.33 110.92 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.9 t -53.62 -41.23 66.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.127 -0.488 . . . . 71.31 110.89 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -57.6 -45.23 85.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 72.14 110.876 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.62 -61.04 2.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 63.45 111.084 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.447 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.5 t80 -52.49 -48.37 65.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 75.51 110.92 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.431 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.32 -49.32 76.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 72.25 110.842 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.43 -41.71 61.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 62.54 111.068 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.752 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.6 mt-30 -70.18 -67.38 0.5 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.449 . . . . 50.13 110.89 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.0 m -46.98 -35.74 3.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 74.13 111.142 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -69.52 -54.25 15.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 73.22 110.92 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.25 -51.75 31.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 72.22 111.124 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.661 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -63.66 -49.13 74.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.167 -0.47 . . . . 72.14 110.876 -179.874 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.65 -36.68 36.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.043 -0.526 . . . . 72.02 110.805 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.12 -54.01 9.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.292 -0.413 . . . . 75.13 111.06 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.29 -28.57 65.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 54.3 110.837 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.661 HG22 ' O ' ' A' ' 60' ' ' PHE . 19.9 m -94.14 -17.38 7.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.147 -0.479 . . . . 72.4 111.185 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -30.98 69.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 74.22 110.935 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.91 -18.86 59.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 75.05 111.136 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -60.33 -75.22 0.06 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.223 -0.444 . . . . 75.41 110.906 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.757 HG22 HG13 ' A' ' 69' ' ' VAL . 93.1 m -53.61 -76.14 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.074 -0.512 . . . . 74.54 111.094 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.757 HG13 HG22 ' A' ' 68' ' ' THR . 17.0 m -149.39 -172.44 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.236 -0.438 . . . . 73.32 111.054 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.403 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -105.92 155.45 38.32 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.52 0.676 . . . . 43.12 111.08 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.471 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.1 Cg_endo -69.68 -6.93 19.74 Favored 'Trans proline' 0 N--CA 1.465 -0.156 0 C-N-CA 122.708 2.272 . . . . 72.52 112.355 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.06 -34.78 9.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 71.53 110.905 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.661 ' O ' HG23 ' A' ' 77' ' ' VAL . 16.4 t80 -58.34 -61.83 2.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 71.33 110.834 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.92 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -39.54 -69.98 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.15 -0.477 . . . . 74.21 111.105 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.41 HG23 ' N ' ' A' ' 76' ' ' LYS . 35.9 m -49.37 -39.81 13.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 71.12 111.136 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.41 ' N ' HG23 ' A' ' 75' ' ' VAL . 7.5 mtmt -61.46 -38.29 86.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.152 -0.476 . . . . 74.41 110.894 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 73' ' ' PHE . 16.6 t -69.81 -38.15 75.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.245 -0.434 . . . . 74.5 111.123 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.2 OUTLIER -69.93 -33.33 72.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.138 -0.483 . . . . 54.24 110.866 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -88.05 -21.83 24.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.149 -0.478 . . . . 74.11 110.924 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.488 ' HG2' HD23 ' A' ' 81' ' ' LEU . 18.7 ttmt -74.16 -50.5 19.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.204 -0.453 . . . . 71.23 110.897 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.799 ' HB2' HD23 ' A' ' 83' ' ' LEU . 12.8 mt -89.71 12.05 18.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.244 -0.434 . . . . 64.35 111.003 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 65.3 m 53.14 39.8 30.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.149 -0.478 . . . . 54.04 110.888 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.799 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.7 mm? -79.56 83.99 5.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.125 -0.489 . . . . 70.21 110.891 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.593 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.43 157.3 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.16 -0.473 . . . . 63.52 111.164 179.913 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -56.29 -23.19 35.07 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.245 -0.434 . . . . 75.24 110.921 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.4 mmtp -80.0 -47.1 15.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 73.01 110.916 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.593 ' H ' HG23 ' A' ' 84' ' ' THR . 8.9 tp10 -67.22 -56.25 10.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.271 -0.422 . . . . 64.1 110.827 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.432 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -50.79 -38.67 49.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 73.15 111.045 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 96.6 p -77.53 -32.3 53.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 62.4 110.86 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -73.72 -28.86 61.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 63.23 110.925 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.774 HD12 ' HB3' ' A' ' 131' ' ' ARG . 11.4 mm -99.92 -63.59 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 61.13 111.192 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.647 ' HB3' HG23 ' A' ' 113' ' ' THR . 8.9 m-85 -70.08 -61.57 1.73 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.128 -0.487 . . . . 75.43 110.863 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 111.95 41.66 1.07 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.755 -0.736 . . . . 44.31 112.458 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -57.83 -44.95 94.07 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.698 -0.763 . . . . 41.52 112.495 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.69 -151.2 16.95 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.799 -0.715 . . . . 71.53 112.505 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.0 t -85.41 -69.1 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.822 0.344 . . . . 62.22 111.104 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -83.33 39.58 0.67 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 71.14 110.876 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.21 -79.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.119 -0.491 . . . . 55.14 111.112 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -37.68 -43.07 0.61 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.343 -0.39 . . . . 75.24 110.874 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.0 -76.45 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 74.31 110.833 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.55 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 55.7 mtt180 -50.09 -49.46 51.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 64.23 110.897 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.486 ' HB3' HD12 ' A' ' 74' ' ' ILE . 8.9 m-85 -51.17 -37.35 45.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.241 -0.436 . . . . 64.35 110.88 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -51.22 -38.33 51.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 74.53 110.871 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.95 -18.56 17.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.105 -0.498 . . . . 61.22 110.902 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.94 26.32 11.71 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.723 -0.751 . . . . 73.05 112.539 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -96.37 -4.18 42.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.892 0.377 . . . . 71.23 110.911 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.55 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -120.69 18.4 11.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 22.02 111.093 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.444 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -126.28 55.91 14.9 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.661 0.743 . . . . 71.14 110.932 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.494 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.4 Cg_endo -69.74 36.51 0.23 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.698 2.266 . . . . 64.45 112.327 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.743 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 4.7 t-160 71.67 34.27 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.576 0.703 . . . . 74.34 110.881 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.743 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.3 Cg_endo -69.79 -164.26 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.648 2.232 . . . . 74.13 112.33 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 28.3 t -83.64 -30.82 26.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.145 -0.48 . . . . 63.14 110.876 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.68 HG22 ' CD1' ' A' ' 117' ' ' LEU . 54.1 m -54.94 -50.68 68.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.108 -0.496 . . . . 73.42 111.102 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.731 HG21 ' CG2' ' A' ' 68' ' ' THR . 44.0 mm -54.21 -47.75 67.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 62.53 111.13 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -28.59 70.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.462 . . . . 73.22 110.968 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.523 ' O ' HD23 ' A' ' 120' ' ' LEU . 5.1 mp -79.59 -42.01 25.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 74.04 110.932 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.92 HD13 HG22 ' A' ' 74' ' ' ILE . 4.4 mt -61.48 -48.55 80.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 65.23 110.917 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.527 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.9 ptp180 -54.06 -35.32 61.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 60.54 110.867 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.584 HG23 HD23 ' A' ' 126' ' ' LEU . 34.5 m -92.97 -10.65 9.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 73.22 111.159 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.747 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.7 OUTLIER -83.42 -39.98 19.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 72.21 110.898 179.971 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -50.33 -31.68 15.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 72.41 110.859 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.16 -19.66 19.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 73.22 110.938 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.747 ' O ' HD13 ' A' ' 120' ' ' LEU . 88.2 m-70 -130.82 90.39 40.13 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.558 0.694 . . . . 61.53 110.876 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.558 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.4 Cg_endo -69.73 0.39 5.69 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.664 2.243 . . . . 63.34 112.289 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -113.93 -11.91 12.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.248 -0.433 . . . . 74.54 110.874 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.694 ' O ' HG23 ' A' ' 130' ' ' ILE . 6.7 tp -53.95 -47.87 70.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 71.22 110.892 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.772 HD13 HD11 ' A' ' 83' ' ' LEU . 2.0 pt? -51.0 -28.76 10.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 64.0 110.985 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.481 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.68 -27.21 23.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 73.41 110.892 179.9 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.403 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.1 pp20? -94.31 2.48 55.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.475 . . . . 71.44 110.839 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.694 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.5 pt -121.12 -33.99 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 75.14 111.174 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.774 ' HB3' HD12 ' A' ' 91' ' ' ILE . 2.3 ptt-85 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 65.42 110.911 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.579 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 4.6 mmt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.877 0.37 . . . . 71.03 110.916 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.77 -169.35 0.41 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 75.44 110.902 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 t -179.44 58.6 0.1 Allowed Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.572 0.701 . . . . 43.34 110.861 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 3.15 2.95 Favored 'Trans proline' 0 N--CA 1.465 -0.2 0 C-N-CA 122.72 2.28 . . . . 71.42 112.389 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.6 m -107.58 -45.71 7.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.199 -0.455 . . . . 73.21 111.077 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -106.92 -33.47 7.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 61.32 110.947 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.6 m-70 59.48 24.85 13.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.14 -0.482 . . . . 72.33 110.827 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -92.14 -67.22 0.87 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 75.22 110.991 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.74 -135.32 6.36 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.729 -0.748 . . . . 52.11 112.477 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.579 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 9.5 pt-20 -145.62 95.23 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.841 0.353 . . . . 70.42 110.913 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.537 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.5 OUTLIER -59.67 104.91 0.32 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.221 -0.445 . . . . 75.52 110.889 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 8.8 p -145.9 133.04 14.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.43 . . . . 64.13 111.145 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.537 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -49.25 132.75 19.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.178 -0.464 . . . . 73.31 110.868 -179.848 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.426 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 178.09 77.58 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.752 -0.737 . . . . 74.04 112.483 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.426 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -35.65 143.8 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.91 0.386 . . . . 74.44 111.094 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.31 -168.15 2.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.132 -0.485 . . . . 73.34 110.912 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -93.27 116.08 28.66 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.22 -0.445 . . . . 75.12 110.88 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.783 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.6 mm -107.68 91.35 7.24 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.654 0.74 . . . . 71.03 111.098 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.495 ' HB3' HG12 ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.8 105.1 1.43 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.716 2.277 . . . . 61.1 112.306 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -70.69 -29.64 66.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.993 0.425 . . . . 63.41 110.932 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.57 HG21 ' HG2' ' A' ' 25' ' ' ARG . 24.3 m -130.74 146.36 52.19 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.114 -0.493 . . . . 61.12 111.231 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -140.17 48.23 1.78 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 73.4 110.908 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.16 -69.03 0.57 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 71.45 110.847 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -134.56 -40.45 0.17 Allowed Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.746 -0.74 . . . . 64.21 112.428 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.57 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -102.95 39.61 1.52 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.901 0.381 . . . . 74.32 110.897 -179.84 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.414 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 11.1 tttt -49.33 109.65 0.29 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 73.32 110.86 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.597 HG21 ' CD1' ' A' ' 60' ' ' PHE . 2.2 t -128.08 92.27 3.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.275 -0.42 . . . . 73.42 111.127 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.495 HG12 ' HB3' ' A' ' 19' ' ' PRO . 0.8 OUTLIER -80.33 140.12 17.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 73.31 111.15 179.865 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.783 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -86.53 63.34 7.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 62.31 110.955 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.9 mttp -41.46 105.56 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 71.22 110.858 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.531 ' O ' HD13 ' A' ' 32' ' ' ILE . . . 115.5 62.1 0.37 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.653 -0.784 . . . . 72.21 112.398 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.598 HD11 ' CB ' ' A' ' 29' ' ' LEU . 19.4 mm -118.31 92.3 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.852 0.358 . . . . 61.5 111.151 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.12 153.25 39.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 61.35 110.827 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 168.22 -109.63 0.35 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.751 -0.738 . . . . 52.54 112.497 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.755 HD12 ' HB ' ' A' ' 44' ' ' ILE . 61.4 mt -156.82 85.81 0.97 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.89 0.376 . . . . 71.4 110.892 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.418 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -158.75 163.35 36.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.161 -0.472 . . . . 74.14 110.895 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -168.38 -47.27 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.068 -0.515 . . . . 73.4 110.93 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.404 HG22 ' HG2' ' A' ' 10' ' ' GLU . 4.2 m -120.54 -47.05 2.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 53.44 111.186 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -87.45 169.42 12.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.167 -0.469 . . . . 71.53 110.849 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.4 m -136.84 15.15 3.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 74.13 110.892 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -103.79 -62.88 1.25 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.157 -0.474 . . . . 54.2 110.925 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.447 ' HG3' ' HE3' ' A' ' 11' ' ' MET . 7.7 tp10 -77.14 61.91 2.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 65.02 110.891 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.3 p -98.03 155.64 17.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.491 . . . . 74.12 110.923 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.755 ' HB ' HD12 ' A' ' 35' ' ' LEU . 21.0 mm -141.84 140.45 30.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.466 . . . . 74.12 111.135 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.8 mtt -144.53 134.79 24.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 73.23 110.884 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.3 m-20 -81.93 -169.85 2.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 64.13 110.851 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.06 -60.1 4.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 53.33 110.934 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -51.76 -57.44 9.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.275 -0.42 . . . . 74.32 110.899 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.42 -58.75 5.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 70.33 110.912 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.9 t -53.74 -38.88 64.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 71.31 110.821 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.75 -43.99 97.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.096 -0.502 . . . . 72.14 110.904 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.83 -58.34 6.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 63.45 111.069 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -54.42 -47.3 72.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.257 -0.429 . . . . 75.51 110.869 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.82 -50.44 68.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.131 -0.486 . . . . 72.25 110.857 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.5 -41.2 60.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 62.54 111.107 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.741 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.4 mt-30 -69.97 -66.99 0.52 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 50.13 110.946 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.43 HG12 HD21 ' A' ' 29' ' ' LEU . 18.1 m -47.82 -35.51 4.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 74.13 111.092 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -69.05 -54.43 15.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 73.22 110.87 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.62 -52.44 39.48 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 72.22 111.134 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.622 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -64.48 -44.69 90.23 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.449 . . . . 72.14 110.893 -179.975 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.0 mtt-85 -50.7 -51.63 47.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.158 -0.473 . . . . 72.02 110.933 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.69 -54.14 36.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 75.13 111.044 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.62 -38.58 32.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 54.3 110.878 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.622 HG23 ' O ' ' A' ' 60' ' ' PHE . 44.4 t -82.4 -25.99 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 72.4 111.121 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -22.98 67.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.159 -0.473 . . . . 74.22 110.867 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.48 -17.0 64.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 75.05 111.145 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -60.41 -20.2 58.81 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.125 -0.488 . . . . 75.41 110.901 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.758 HG22 HG13 ' A' ' 69' ' ' VAL . 92.8 m -158.51 -75.74 0.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 74.54 111.179 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.758 HG13 HG22 ' A' ' 68' ' ' THR . 17.6 m -148.62 -172.77 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 73.32 111.136 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -103.14 153.73 38.15 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.541 0.686 . . . . 43.12 111.021 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.528 ' HA ' HD11 ' A' ' 74' ' ' ILE . 54.2 Cg_endo -69.67 -7.69 21.68 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.685 2.257 . . . . 72.52 112.367 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -98.85 -36.31 9.83 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.201 -0.454 . . . . 71.53 110.852 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.564 ' O ' HG23 ' A' ' 77' ' ' VAL . 19.8 t80 -57.76 -61.13 2.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.194 -0.457 . . . . 71.33 110.896 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.77 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -40.01 -70.47 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 74.21 111.17 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.7 m -48.85 -38.87 10.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.151 -0.477 . . . . 71.12 111.205 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.6 mtmt -62.77 -39.05 92.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 74.41 110.802 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 73' ' ' PHE . 39.3 t -68.07 -38.07 79.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.268 -0.424 . . . . 74.5 111.121 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.423 ' HG3' ' O ' ' A' ' 74' ' ' ILE . 0.7 OUTLIER -70.33 -36.51 74.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 54.24 110.851 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -84.08 -20.84 31.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.169 -0.469 . . . . 74.11 110.895 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.462 ' HG2' HD23 ' A' ' 81' ' ' LEU . 5.5 ttmt -75.59 -50.19 16.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 71.23 110.87 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.816 ' HB2' HD23 ' A' ' 83' ' ' LEU . 12.9 mt -90.19 12.22 18.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 64.35 110.918 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.3 t 52.47 40.8 30.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 54.04 110.851 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.816 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.6 mm? -79.13 84.61 5.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 70.21 110.864 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.595 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.29 156.33 0.11 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 63.52 111.131 179.943 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -58.33 -24.7 60.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 75.24 110.9 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -77.08 -49.01 16.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 73.01 110.945 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.595 ' H ' HG23 ' A' ' 84' ' ' THR . 0.8 OUTLIER -68.98 -54.83 13.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.226 -0.443 . . . . 64.1 110.919 179.903 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.572 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -51.69 -35.35 42.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 73.15 111.104 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.2 m -78.67 -37.07 42.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 62.4 110.892 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -72.76 -24.79 61.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.128 -0.487 . . . . 63.23 110.82 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.717 ' CD1' HD12 ' A' ' 127' ' ' LEU . 51.9 mt -101.47 -64.09 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 61.13 111.112 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.54 ' HB3' HG23 ' A' ' 113' ' ' THR . 8.0 m-85 -71.72 -61.26 1.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 75.43 110.975 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.65 45.01 1.0 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.796 -0.716 . . . . 44.31 112.458 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -66.59 -46.62 74.9 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.751 -0.738 . . . . 41.52 112.564 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.49 172.54 21.45 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.717 -0.754 . . . . 71.53 112.5 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.675 HG13 ' H ' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -50.9 -66.64 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.869 0.366 . . . . 62.22 111.099 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.675 ' H ' HG13 ' A' ' 96' ' ' VAL . 9.0 t30 -86.24 42.23 0.98 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.155 -0.475 . . . . 71.14 110.882 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.13 -76.18 0.06 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 55.14 111.145 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -39.66 -40.32 0.89 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 75.24 110.866 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.9 m -59.93 -76.28 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.163 -0.471 . . . . 74.31 110.89 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.604 ' HB3' ' HB2' ' A' ' 107' ' ' ALA . 24.6 mtt85 -49.93 -45.66 51.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.102 -0.499 . . . . 64.23 110.885 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.491 ' HB3' HD12 ' A' ' 74' ' ' ILE . 10.4 m-85 -56.96 -36.57 70.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 64.35 110.943 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 -59.81 -25.98 65.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.104 -0.498 . . . . 74.53 110.891 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.11 -20.5 14.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 61.22 110.903 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.15 28.38 11.9 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.742 -0.742 . . . . 73.05 112.564 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 60.1 m-20 -104.35 -8.65 19.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.819 0.342 . . . . 71.23 110.926 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.604 ' HB2' ' HB3' ' A' ' 101' ' ' ARG . . . -114.52 15.14 17.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 22.02 111.12 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.443 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 0.0 OUTLIER -127.04 54.6 12.63 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.529 0.68 . . . . 71.14 110.904 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.502 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 54.0 Cg_endo -69.75 37.03 0.24 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.642 2.228 . . . . 64.45 112.347 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.748 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.5 t-160 71.9 34.06 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.65 0.738 . . . . 74.34 110.856 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.748 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.4 Cg_endo -69.77 -164.07 0.12 Allowed 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.665 2.243 . . . . 74.13 112.412 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.94 -32.77 30.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.311 -0.404 . . . . 63.14 110.874 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.54 HG23 ' HB3' ' A' ' 92' ' ' PHE . 21.0 m -52.3 -55.35 21.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.476 . . . . 73.42 111.176 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.719 HG21 ' CG2' ' A' ' 68' ' ' THR . 42.7 mm -50.94 -46.55 30.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 62.53 111.116 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.442 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -62.52 -28.53 69.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 73.22 110.894 179.853 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.442 HD12 ' HG3' ' A' ' 115' ' ' LYS . 5.8 mp -81.29 -47.5 13.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.265 -0.425 . . . . 74.04 110.922 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.77 HD13 HG22 ' A' ' 74' ' ' ILE . 21.5 mt -55.91 -47.75 76.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.47 . . . . 65.23 110.995 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.614 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.0 ptp180 -54.91 -35.6 64.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 60.54 110.915 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.614 HG13 ' HG3' ' A' ' 118' ' ' ARG . 31.7 m -95.7 -3.46 10.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 73.22 111.145 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.747 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -89.68 -40.73 12.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 72.21 110.909 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -49.31 -32.43 11.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.256 -0.429 . . . . 72.41 110.849 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.47 -20.53 18.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 73.22 110.856 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.747 ' O ' HD13 ' A' ' 120' ' ' LEU . 48.0 m-70 -127.36 87.34 56.53 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.602 0.715 . . . . 61.53 110.865 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.602 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.6 Cg_endo -69.73 3.9 2.49 Favored 'Trans proline' 0 C--N 1.341 0.14 0 C-N-CA 122.747 2.298 . . . . 63.34 112.338 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -117.91 -12.42 10.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 74.54 110.897 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.557 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.7 tp -53.6 -48.09 69.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 71.22 110.958 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.717 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.8 pt? -46.33 -32.75 3.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 64.0 110.922 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -81.96 -38.08 25.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 73.41 110.927 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.551 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -78.72 -5.72 53.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.479 . . . . 71.44 110.892 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.557 HG23 ' O ' ' A' ' 126' ' ' LEU . 8.7 pt -118.14 -22.26 4.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.152 -0.476 . . . . 75.14 111.133 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.193 -0.458 . . . . 65.42 110.889 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mtt . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.838 0.352 . . . . 71.03 110.879 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.24 -171.21 0.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.192 -0.458 . . . . 75.44 110.906 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.403 ' N ' ' CD ' ' A' ' 4' ' ' PRO . 0.5 OUTLIER 175.79 56.72 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.651 0.739 . . . . 43.34 110.96 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 3' ' ' CYS . 53.3 Cg_endo -69.73 2.39 3.56 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.724 2.282 . . . . 71.42 112.327 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.596 HG23 ' HG3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -99.89 -44.6 11.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.448 . . . . 73.21 111.144 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 7' ' ' HIS . 0.1 OUTLIER -112.2 -40.01 4.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.169 -0.469 . . . . 61.32 110.894 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 24.6 m-70 69.29 51.63 0.5 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 72.33 110.854 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -120.31 -71.95 0.71 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 75.22 110.949 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -99.61 -121.38 4.6 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.669 -0.776 . . . . 52.11 112.556 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.504 ' O ' HG12 ' A' ' 12' ' ' VAL . 12.8 pt-20 -169.29 87.52 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.804 0.335 . . . . 70.42 110.938 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.522 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -46.04 105.71 0.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 75.52 110.869 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.504 HG12 ' O ' ' A' ' 10' ' ' GLU . 4.9 p -144.57 129.2 13.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 64.13 111.148 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.494 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.6 p -47.5 126.23 9.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 73.31 110.89 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.88 80.99 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.692 -0.766 . . . . 74.04 112.429 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.409 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.27 147.24 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.88 0.371 . . . . 74.44 111.097 -179.955 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.32 -165.32 1.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 73.34 110.899 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.656 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -96.54 117.34 30.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.262 -0.426 . . . . 75.12 110.851 179.914 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.724 ' O ' HD22 ' A' ' 29' ' ' LEU . 10.7 mm -108.05 91.3 7.68 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.639 0.733 . . . . 71.03 111.146 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.402 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.1 Cg_endo -69.7 96.26 0.58 Allowed 'Trans proline' 0 N--CA 1.464 -0.217 0 C-N-CA 122.754 2.302 . . . . 61.1 112.38 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.499 ' HB3' HG23 ' A' ' 27' ' ' THR . 14.2 t80 -64.29 -34.61 78.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 63.41 110.926 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.586 HG21 ' HG2' ' A' ' 25' ' ' ARG . 17.5 m -130.29 146.89 51.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 61.12 111.155 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -144.63 43.49 1.37 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 73.4 110.917 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.408 ' CD ' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -131.28 -39.64 1.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 71.45 110.802 -179.869 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -160.48 -53.23 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.736 -0.745 . . . . 64.21 112.495 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.586 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.75 42.44 1.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.867 0.365 . . . . 74.32 110.925 -179.897 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.402 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 15.1 tttm -49.77 117.47 2.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 73.32 110.893 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.499 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -128.91 91.04 3.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 73.42 111.08 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.656 HG11 ' HB2' ' A' ' 17' ' ' ASP . 43.0 t -76.62 126.7 37.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.232 -0.44 . . . . 73.31 111.132 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.73 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.77 51.78 2.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 62.31 110.913 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -38.59 107.47 0.07 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 71.22 110.922 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.24 46.09 0.38 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.755 -0.736 . . . . 72.21 112.5 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.566 HD11 ' HB3' ' A' ' 29' ' ' LEU . 13.4 mm -107.37 89.98 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.923 0.392 . . . . 61.5 111.146 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.33 156.43 38.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 61.35 110.875 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.13 -107.39 0.28 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.721 -0.752 . . . . 52.54 112.456 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.732 HD12 ' HB ' ' A' ' 44' ' ' ILE . 55.6 mt -156.27 82.47 0.99 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.896 0.379 . . . . 71.4 110.87 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.469 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -164.88 166.23 19.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.46 . . . . 74.14 110.91 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.5 -34.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 73.4 110.85 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.3 m -121.34 -45.28 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 53.44 111.087 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -98.94 176.02 5.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 71.53 110.856 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.5 p -141.25 28.81 1.84 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.205 -0.452 . . . . 74.13 110.85 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -110.49 -65.68 1.14 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.173 -0.467 . . . . 54.2 110.922 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.596 ' HG3' HG23 ' A' ' 5' ' ' VAL . 27.4 mm-40 -76.56 62.29 1.9 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 65.02 110.937 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.1 p -93.05 138.62 31.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 74.12 110.874 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.732 ' HB ' HD12 ' A' ' 35' ' ' LEU . 13.3 mm -135.71 138.91 47.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.086 -0.507 . . . . 74.12 111.115 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 15.2 mtt -139.3 143.19 37.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 73.23 110.854 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.6 m-20 -90.82 -168.91 2.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 64.13 110.844 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.17 -60.41 3.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.131 -0.486 . . . . 53.33 110.996 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.92 -58.24 7.61 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.139 -0.482 . . . . 74.32 110.9 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -50.5 -59.35 4.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 70.33 110.915 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 37.0 t -52.45 -42.91 64.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 71.31 110.78 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -57.38 -43.38 83.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.152 -0.476 . . . . 72.14 110.842 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.45 -61.93 1.82 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 63.45 111.113 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.477 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.7 t80 -52.56 -45.84 66.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.179 -0.464 . . . . 75.51 110.887 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.434 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -64.2 -50.41 68.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 72.25 110.842 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.21 -41.73 60.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.303 -0.408 . . . . 62.54 111.153 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.73 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.5 mt-30 -70.64 -66.99 0.53 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 50.13 110.93 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.477 HG13 ' O ' ' A' ' 53' ' ' PHE . 16.3 m -47.03 -35.64 3.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.257 -0.429 . . . . 74.13 111.094 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 11.0 mmmm -70.31 -51.91 26.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 73.22 110.939 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.4 -52.32 46.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.47 . . . . 72.22 111.14 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.644 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -65.29 -46.24 81.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 72.14 110.883 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -49.88 -52.49 32.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.104 -0.498 . . . . 72.02 110.866 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.82 -54.54 33.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 75.13 111.094 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.69 -42.05 33.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 54.3 110.836 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 60' ' ' PHE . 42.9 t -77.15 -28.49 16.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.164 -0.471 . . . . 72.4 111.142 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -20.62 59.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 74.22 110.853 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.69 -23.04 58.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 75.05 111.093 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -56.96 -75.18 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 75.41 110.933 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.759 HG22 HG13 ' A' ' 69' ' ' VAL . 93.6 m -149.39 -75.96 0.16 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 74.54 111.102 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.759 HG13 HG22 ' A' ' 68' ' ' THR . 17.0 m -149.59 -172.56 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.229 -0.441 . . . . 73.32 111.049 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.5 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -104.92 158.17 32.61 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.547 0.689 . . . . 43.12 111.075 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.5 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.8 Cg_endo -69.79 -8.15 22.88 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.604 2.202 . . . . 72.52 112.42 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -97.81 -34.87 10.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 71.53 110.797 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -57.5 -61.12 2.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.454 . . . . 71.33 110.9 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.867 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -44.82 -68.04 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 74.21 111.104 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -48.66 -38.88 10.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 71.12 111.177 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.8 mtmt -61.14 -45.5 94.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.456 . . . . 74.41 110.935 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.534 HG22 ' HB2' ' A' ' 121' ' ' ASP . 78.5 t -62.03 -39.48 83.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 74.5 111.112 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.465 HH22 HG21 ' A' ' 113' ' ' THR . 0.2 OUTLIER -63.64 -58.65 6.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 54.24 110.854 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -24.1 67.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 74.11 110.979 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.2 ttmt -67.97 -53.67 24.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 71.23 110.879 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.807 ' HB2' HD23 ' A' ' 83' ' ' LEU . 10.9 mt -90.68 12.79 17.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.192 -0.458 . . . . 64.35 110.947 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.3 t 53.5 38.41 28.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.117 -0.492 . . . . 54.04 110.915 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.807 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.8 mm? -79.58 87.04 5.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.127 -0.488 . . . . 70.21 110.943 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.637 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -45.55 157.4 0.1 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 63.52 111.115 179.976 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -57.55 -21.49 38.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 75.24 110.921 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -81.16 -49.21 11.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 73.01 110.957 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.637 ' H ' HG23 ' A' ' 84' ' ' THR . 21.9 tp10 -62.47 -54.31 42.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.448 . . . . 64.1 110.863 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.41 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -54.72 -35.8 64.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.483 . . . . 73.15 111.083 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 91.5 p -79.68 -26.11 41.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 62.4 110.832 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.93 -25.88 34.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.469 . . . . 63.23 110.873 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.734 HD12 ' HB3' ' A' ' 131' ' ' ARG . 24.5 mm -103.35 -59.05 3.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.157 -0.474 . . . . 61.13 111.17 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.581 ' HB3' HG23 ' A' ' 113' ' ' THR . 5.8 m-85 -75.77 -60.96 2.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 75.43 110.87 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 109.3 49.44 0.76 Allowed Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.711 -0.756 . . . . 44.31 112.527 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.79 -37.39 34.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 41.52 112.509 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.418 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 102.11 165.71 26.8 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.685 -0.769 . . . . 71.53 112.467 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.493 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.9 p -51.4 -50.67 27.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.832 0.348 . . . . 62.22 111.15 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.493 ' N ' HG13 ' A' ' 96' ' ' VAL . 14.2 p30 -86.93 37.73 0.77 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.159 -0.473 . . . . 71.14 110.928 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.418 ' HB2' ' O ' ' A' ' 95' ' ' GLY . . . -64.46 -76.43 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 55.14 111.11 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -43.25 -39.97 3.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 75.24 110.893 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.37 -75.38 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 74.31 110.876 -179.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.619 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 44.6 mtt180 -49.92 -45.02 50.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.075 -0.512 . . . . 64.23 110.892 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.723 ' HB3' HD12 ' A' ' 74' ' ' ILE . 9.0 m-85 -56.35 -37.54 70.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 64.35 110.909 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -53.35 -27.43 23.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.075 -0.511 . . . . 74.53 110.892 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.56 -22.2 12.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.127 -0.488 . . . . 61.22 110.9 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.23 28.16 9.43 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.77 -0.729 . . . . 73.05 112.48 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 65.3 m-20 -100.36 -6.87 25.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.362 . . . . 71.23 110.915 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.619 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -109.74 10.68 24.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.189 -0.46 . . . . 22.02 111.101 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.45 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -125.61 56.96 16.11 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.585 0.707 . . . . 71.14 110.96 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.532 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.8 Cg_endo -69.75 36.38 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.698 2.265 . . . . 64.45 112.317 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.773 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 2.6 t60 73.89 32.33 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.646 0.736 . . . . 74.34 110.865 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.773 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 52.9 Cg_endo -69.8 -163.98 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.721 2.281 . . . . 74.13 112.301 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.0 p -86.94 -28.95 22.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.235 -0.439 . . . . 63.14 110.87 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.583 HG22 HD12 ' A' ' 117' ' ' LEU . 22.0 m -53.5 -51.38 62.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.162 -0.472 . . . . 73.42 111.17 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.69 HG21 ' CG2' ' A' ' 68' ' ' THR . 38.9 mm -51.26 -42.52 26.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 62.53 111.105 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.537 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -67.44 -29.92 69.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.154 -0.475 . . . . 73.22 110.915 179.815 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.537 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.7 mp -79.23 -41.72 27.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.456 . . . . 74.04 110.922 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.867 HD13 HG22 ' A' ' 74' ' ' ILE . 13.8 mt -63.66 -49.51 72.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.166 -0.47 . . . . 65.23 110.902 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.58 ' HG3' HG13 ' A' ' 119' ' ' VAL . 14.5 ptp180 -52.07 -35.7 48.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 60.54 110.882 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.58 HG13 ' HG3' ' A' ' 118' ' ' ARG . 31.0 m -92.57 -14.07 8.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 73.22 111.099 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.768 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -77.04 -39.64 49.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.268 -0.424 . . . . 72.21 110.874 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.534 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.8 OUTLIER -50.44 -31.44 15.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.174 -0.466 . . . . 72.41 110.871 179.873 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -95.8 -19.86 19.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 73.22 110.966 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.768 ' O ' HD13 ' A' ' 120' ' ' LEU . 81.7 m-70 -131.41 90.07 38.92 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 121.589 0.709 . . . . 61.53 110.801 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.723 ' HB3' HD22 ' A' ' 81' ' ' LEU . 54.0 Cg_endo -69.71 0.13 6.05 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.745 2.297 . . . . 63.34 112.324 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -113.8 -11.95 12.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 74.54 110.882 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.68 ' O ' HG23 ' A' ' 130' ' ' ILE . 6.3 tp -53.6 -47.84 69.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.118 -0.492 . . . . 71.22 110.96 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.748 HD13 HD11 ' A' ' 83' ' ' LEU . 2.2 pt? -51.1 -29.0 11.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.12 -0.491 . . . . 64.0 110.968 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.487 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.67 -26.07 24.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.174 -0.466 . . . . 73.41 110.906 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.413 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.0 OUTLIER -95.88 3.31 53.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 71.44 110.917 179.943 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.68 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.8 pt -122.25 -34.52 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 75.14 111.093 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.734 ' HB3' HD12 ' A' ' 91' ' ' ILE . 1.3 ptt-85 . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 65.42 110.84 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mtt . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.884 0.374 . . . . 71.03 110.835 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.63 -169.53 0.43 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.429 . . . . 75.44 110.891 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.5 p 176.88 57.17 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.623 0.725 . . . . 43.34 110.875 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.79 0.52 5.55 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.715 2.277 . . . . 71.42 112.302 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 2.9 m -91.99 -40.37 12.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 73.21 111.2 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 7' ' ' HIS . 0.0 OUTLIER -122.9 -36.33 2.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 61.32 110.858 179.981 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 24.0 m-70 70.49 61.84 0.21 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 72.33 110.844 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -127.8 -77.15 0.57 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 75.22 110.96 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.402 ' HA3' ' HB3' ' A' ' 39' ' ' HIS . . . -94.43 -118.02 2.98 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.785 -0.722 . . . . 52.11 112.478 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.585 ' O ' HG12 ' A' ' 12' ' ' VAL . 8.2 pt-20 -177.45 96.57 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.905 0.383 . . . . 70.42 110.935 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.462 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -48.36 103.74 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 75.52 110.89 -179.974 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.585 HG12 ' O ' ' A' ' 10' ' ' GLU . 3.1 p -141.71 125.11 15.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 64.13 111.117 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.508 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.2 p -46.66 128.55 10.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.256 -0.429 . . . . 73.31 110.909 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.423 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . -179.7 79.94 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.722 -0.751 . . . . 74.04 112.47 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.423 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.8 OUTLIER -36.42 146.16 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.905 0.383 . . . . 74.44 111.151 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.8 -166.3 1.96 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 73.34 110.906 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.636 ' HB2' HG11 ' A' ' 28' ' ' VAL . 1.4 p30 -94.63 119.73 33.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 75.12 110.825 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.712 ' O ' HD22 ' A' ' 29' ' ' LEU . 10.3 mm -110.78 92.15 13.97 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.596 0.713 . . . . 71.03 111.181 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.416 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.8 Cg_endo -69.67 94.87 0.53 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.696 2.264 . . . . 61.1 112.369 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -60.75 -39.02 87.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 63.41 110.961 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.416 HG21 ' HG2' ' A' ' 25' ' ' ARG . 11.3 m -130.67 145.12 51.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.072 -0.513 . . . . 61.12 111.153 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 16.4 p90 -136.12 47.49 2.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.231 -0.44 . . . . 73.4 110.938 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.51 -68.58 0.57 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 71.45 110.89 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.07 -44.88 0.1 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.746 -0.74 . . . . 64.21 112.494 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.416 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -97.79 40.37 1.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.907 0.384 . . . . 74.32 110.92 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -53.92 124.22 14.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 73.32 110.9 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.403 ' O ' HG23 ' A' ' 27' ' ' THR . 1.7 t -139.2 94.46 2.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.142 -0.481 . . . . 73.42 111.131 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.636 HG11 ' HB2' ' A' ' 17' ' ' ASP . 45.1 t -76.8 127.4 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 73.31 111.151 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.764 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.86 51.57 2.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.172 -0.467 . . . . 62.31 110.916 179.956 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 29' ' ' LEU . 22.0 mttp -38.46 107.22 0.06 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 71.22 110.888 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.52 45.51 0.39 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.767 -0.73 . . . . 72.21 112.487 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.558 HD11 ' HB3' ' A' ' 29' ' ' LEU . 15.2 mm -106.3 91.38 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.854 0.359 . . . . 61.5 111.097 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.0 156.87 37.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 61.35 110.827 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.22 -106.89 0.28 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.79 -0.719 . . . . 52.54 112.518 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.753 HD12 ' HB ' ' A' ' 44' ' ' ILE . 50.3 mt -156.17 83.35 1.0 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.88 0.372 . . . . 71.4 110.845 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.534 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -167.97 161.69 12.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.489 . . . . 74.14 110.909 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.35 -33.61 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.161 -0.472 . . . . 73.4 110.886 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.402 HG11 ' HG2' ' A' ' 10' ' ' GLU . 4.5 p -118.93 -24.7 3.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 53.44 111.128 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.402 ' HB3' ' HA3' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -126.17 177.96 6.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.166 -0.47 . . . . 71.53 110.809 179.978 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.8 p -138.92 9.95 2.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 74.13 110.885 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -92.98 -66.04 0.95 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 54.2 110.901 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -75.71 60.92 1.33 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.49 . . . . 65.02 110.87 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.9 p -94.19 149.54 21.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.15 -0.477 . . . . 74.12 110.88 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.753 ' HB ' HD12 ' A' ' 35' ' ' LEU . 16.5 mm -144.1 137.95 24.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.481 . . . . 74.12 111.156 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.7 mtt -139.65 143.58 37.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.246 -0.434 . . . . 73.23 110.863 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -97.14 -168.55 1.72 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 64.13 110.853 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.48 -56.32 19.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.116 -0.493 . . . . 53.33 110.926 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -57.0 -58.3 8.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 74.32 110.928 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.68 -60.29 3.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.133 -0.485 . . . . 70.33 110.891 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.2 t -53.37 -39.41 64.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 71.31 110.856 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.69 -45.83 88.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.088 -0.505 . . . . 72.14 110.863 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.86 -59.16 4.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 63.45 111.089 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.455 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.1 t80 -53.3 -48.23 68.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.17 -0.468 . . . . 75.51 110.858 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.421 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.24 -48.72 77.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 72.25 110.914 179.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.5 -40.49 62.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 62.54 111.072 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.764 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.7 mt-30 -71.09 -66.63 0.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.147 -0.478 . . . . 50.13 110.884 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 53' ' ' PHE . 12.2 m -47.6 -35.16 4.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.171 -0.468 . . . . 74.13 111.096 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -71.19 -52.04 21.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 73.22 110.918 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.47 -49.0 62.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.449 . . . . 72.22 111.129 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.618 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -67.0 -48.09 69.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 72.14 110.946 -179.965 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -49.67 -48.96 49.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 72.02 110.881 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.36 -55.88 13.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.491 . . . . 75.13 111.125 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.54 -40.88 39.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.21 -0.45 . . . . 54.3 110.84 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 60' ' ' PHE . 36.4 t -80.27 -25.28 11.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 72.4 111.15 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -21.24 66.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 74.22 110.901 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.91 -13.73 60.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 75.05 111.094 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -69.51 -12.0 61.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 75.41 110.829 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 43.3 m -127.35 -76.6 0.57 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 74.54 111.131 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.557 HG11 HG23 ' A' ' 74' ' ' ILE . 0.9 OUTLIER -147.76 141.55 19.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.171 -0.468 . . . . 73.32 111.081 179.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.609 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -81.76 161.14 62.18 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.552 0.691 . . . . 43.12 111.071 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.609 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.5 Cg_endo -69.76 -6.98 19.89 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.706 2.271 . . . . 72.52 112.311 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -99.82 -37.8 8.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 71.53 110.89 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -57.04 -62.17 1.94 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.143 -0.48 . . . . 71.33 110.879 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.7 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -43.73 -68.09 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 74.21 111.102 179.963 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.5 m -49.08 -39.1 11.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.111 -0.495 . . . . 71.12 111.092 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -61.42 -37.77 84.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 74.41 110.825 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.487 HG22 ' HB2' ' A' ' 121' ' ' ASP . 97.2 t -70.67 -38.39 72.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.274 -0.421 . . . . 74.5 111.127 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.9 OUTLIER -69.83 -33.22 72.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 54.24 110.899 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -89.75 -19.17 25.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 74.11 110.886 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.2 ttmm -75.85 -51.62 12.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.265 -0.425 . . . . 71.23 110.861 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.838 HD13 HD12 ' A' ' 120' ' ' LEU . 7.3 mt -91.49 14.47 14.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.245 -0.434 . . . . 64.35 110.922 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.02 43.19 29.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.439 . . . . 54.04 110.915 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.805 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.3 mm? -79.18 86.07 5.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.099 -0.5 . . . . 70.21 110.925 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.593 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.1 OUTLIER -46.85 155.8 0.24 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 63.52 111.14 179.92 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.61 -22.24 61.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 75.24 110.991 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -77.34 -54.25 6.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 73.01 110.949 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.593 ' H ' HG23 ' A' ' 84' ' ' THR . 0.1 OUTLIER -65.5 -51.75 57.77 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.181 -0.463 . . . . 64.1 110.969 179.899 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.428 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -53.91 -32.68 54.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 73.15 111.021 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 13.7 t -80.34 -35.8 35.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 62.4 110.842 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -75.77 -21.13 57.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.088 -0.506 . . . . 63.23 110.896 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.728 ' CD1' HD12 ' A' ' 127' ' ' LEU . 55.7 mt -104.93 -62.35 2.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 61.13 111.112 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.54 ' HB3' HG23 ' A' ' 113' ' ' THR . 7.4 m-85 -75.31 -61.58 1.85 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 75.43 110.921 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 113.17 48.16 0.62 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.723 -0.751 . . . . 44.31 112.422 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.455 ' C ' ' HB2' ' A' ' 98' ' ' ALA . . . -69.78 -41.06 74.95 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.732 -0.747 . . . . 41.52 112.436 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 100.87 -155.85 19.27 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.76 -0.733 . . . . 71.53 112.533 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.5 t -80.56 -70.25 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 62.22 111.161 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -84.9 41.24 0.85 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.112 -0.494 . . . . 71.14 110.913 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.455 ' HB2' ' C ' ' A' ' 94' ' ' GLY . . . -61.61 -73.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 55.14 111.041 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -40.36 -41.68 1.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 75.24 110.871 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -60.1 -75.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 74.31 110.893 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.603 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 10.5 mtt180 -48.5 -47.9 38.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 64.23 110.886 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.572 ' HB3' HD12 ' A' ' 74' ' ' ILE . 10.5 m-85 -55.02 -37.78 67.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 64.35 110.943 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -53.3 -31.84 45.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 74.53 110.919 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.84 -20.5 14.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.116 -0.493 . . . . 61.22 110.909 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.63 25.41 13.58 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.731 -0.747 . . . . 73.05 112.541 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -98.38 -5.31 32.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.884 0.373 . . . . 71.23 110.909 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.603 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -118.02 17.17 14.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 22.02 111.093 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.448 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 0.0 OUTLIER -126.32 54.01 10.37 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.572 0.701 . . . . 71.14 110.948 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.506 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.2 Cg_endo -69.66 39.79 0.28 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.705 2.27 . . . . 64.45 112.34 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.736 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.3 m170 71.0 35.51 0.09 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.546 0.689 . . . . 74.34 110.898 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.736 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.2 Cg_endo -69.75 -164.05 0.12 Allowed 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.641 2.228 . . . . 74.13 112.353 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.501 ' O ' HD13 ' A' ' 116' ' ' LEU . 1.5 m -89.17 -23.84 22.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 63.14 110.831 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.54 HG23 ' HB3' ' A' ' 92' ' ' PHE . 21.1 m -61.49 -45.95 92.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.114 -0.494 . . . . 73.42 111.139 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 44.0 mm -56.35 -43.38 77.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 62.53 111.064 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.517 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -69.24 -33.75 73.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.142 -0.481 . . . . 73.22 110.873 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.712 ' HG ' HD12 ' A' ' 130' ' ' ILE . 7.5 mp -74.39 -38.12 63.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.235 -0.438 . . . . 74.04 110.918 179.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.7 HD13 HG22 ' A' ' 74' ' ' ILE . 33.7 mt -68.46 -51.42 43.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 65.23 110.974 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.559 ' HG3' HG13 ' A' ' 119' ' ' VAL . 14.7 ptp180 -50.33 -34.46 23.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.206 -0.452 . . . . 60.54 110.864 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.785 HG23 HD13 ' A' ' 126' ' ' LEU . 21.7 m -91.75 -19.98 6.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.224 -0.443 . . . . 73.22 111.085 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.838 HD12 HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -72.78 -44.58 61.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.171 -0.468 . . . . 72.21 110.92 179.963 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.487 ' HB2' HG22 ' A' ' 77' ' ' VAL . 9.9 t0 -48.54 -29.45 4.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 72.41 110.794 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -91.78 -30.16 16.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.465 . . . . 73.22 110.894 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.618 ' O ' HD13 ' A' ' 120' ' ' LEU . 19.1 m-70 -128.06 98.37 27.2 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.552 0.692 . . . . 61.53 110.857 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.535 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.4 Cg_endo -69.8 3.93 2.51 Favored 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.652 2.235 . . . . 63.34 112.357 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -115.2 -12.58 11.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.257 -0.429 . . . . 74.54 110.878 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.785 HD13 HG23 ' A' ' 119' ' ' VAL . 2.1 mt -50.42 -48.53 56.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 71.22 110.924 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.728 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.67 -29.47 7.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 64.0 110.978 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.476 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.3 m-80 -86.85 -26.9 23.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 73.41 110.902 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.437 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.9 OUTLIER -96.89 7.81 45.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 71.44 110.885 -180.0 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.712 HD12 ' HG ' ' A' ' 116' ' ' LEU . 7.8 pt -128.06 -34.32 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 75.14 111.103 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.476 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 0.9 OUTLIER . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.253 -0.431 . . . . 65.42 110.858 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.594 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 1.4 mmt . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.893 0.378 . . . . 71.03 110.883 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.66 -169.2 0.41 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 75.44 110.893 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.1 p 177.64 58.39 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.641 0.734 . . . . 43.34 110.844 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 1.94 3.95 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.71 2.274 . . . . 71.42 112.348 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.604 HG21 ' CD ' ' A' ' 42' ' ' GLU . 23.8 m -92.78 -37.28 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 73.21 111.184 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -127.26 -33.46 2.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.155 -0.475 . . . . 61.32 110.88 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 66.4 57.67 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 72.33 110.806 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 93.4 mm-40 -121.3 -75.92 0.59 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.224 -0.444 . . . . 75.22 110.914 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -99.09 -114.74 3.55 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.682 -0.771 . . . . 52.11 112.477 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.594 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 7.6 pt-20 -174.3 98.07 0.1 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.803 0.335 . . . . 70.42 110.866 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.561 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.6 ptp -59.63 107.4 0.59 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.201 -0.454 . . . . 75.52 110.824 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 6.6 p -146.7 127.44 6.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 64.13 111.157 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.606 ' N ' HD23 ' A' ' 35' ' ' LEU . 5.8 p -48.61 135.81 14.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.449 . . . . 73.31 110.86 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.435 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 174.41 77.29 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.784 -0.722 . . . . 74.04 112.531 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.435 ' C ' ' O ' ' A' ' 14' ' ' GLY . 0.7 OUTLIER -33.71 141.35 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.897 0.379 . . . . 74.44 111.102 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.17 -168.14 2.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.441 . . . . 73.34 110.939 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -93.2 116.25 28.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.271 -0.422 . . . . 75.12 110.913 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.78 ' O ' HD22 ' A' ' 29' ' ' LEU . 8.6 mm -107.91 91.27 7.44 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.653 0.739 . . . . 71.03 111.058 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.477 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 54.4 Cg_endo -69.71 103.85 1.22 Allowed 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.688 2.258 . . . . 61.1 112.379 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -68.72 -34.2 75.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 63.41 110.926 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.529 HG21 ' HG2' ' A' ' 25' ' ' ARG . 27.5 m -128.05 147.37 50.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.107 -0.497 . . . . 61.12 111.077 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -141.62 47.78 1.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 73.4 110.91 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.18 -68.7 0.55 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.116 -0.493 . . . . 71.45 110.863 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -132.32 -42.92 0.17 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.708 -0.758 . . . . 64.21 112.404 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.529 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -102.05 40.46 1.33 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.842 0.353 . . . . 74.32 110.87 -179.803 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.41 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 8.7 tttm -50.08 113.9 0.97 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 73.32 110.91 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.577 HG21 ' CD2' ' A' ' 60' ' ' PHE . 2.1 t -134.65 94.76 3.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 73.42 111.151 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.477 ' HA ' ' HA ' ' A' ' 19' ' ' PRO . 0.8 OUTLIER -82.15 140.29 16.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 73.31 111.122 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.78 HD22 ' O ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -86.46 63.32 7.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 62.31 110.983 179.929 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -41.6 105.22 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 71.22 110.852 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.522 ' O ' HD13 ' A' ' 32' ' ' ILE . . . 115.37 62.46 0.37 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.737 -0.744 . . . . 72.21 112.516 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.618 HD11 ' CB ' ' A' ' 29' ' ' LEU . 19.9 mm -118.05 93.3 2.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.827 0.346 . . . . 61.5 111.147 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.81 152.3 38.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 61.35 110.907 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.58 -109.42 0.34 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.689 -0.767 . . . . 52.54 112.46 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.741 HD12 ' HB ' ' A' ' 44' ' ' ILE . 51.6 mt -156.76 86.31 0.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.805 0.336 . . . . 71.4 110.881 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.47 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -160.77 159.85 30.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 74.14 110.922 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 32.3 t -164.05 -46.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.088 -0.505 . . . . 73.4 110.92 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.0 m -120.37 -47.05 2.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.198 -0.455 . . . . 53.44 111.105 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -87.96 171.45 10.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 71.53 110.811 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -137.64 9.99 2.9 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.218 -0.446 . . . . 74.13 110.878 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -99.24 -62.73 1.2 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 54.2 110.89 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.604 ' CD ' HG21 ' A' ' 5' ' ' VAL . 14.4 tp10 -76.95 61.56 1.97 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 65.02 110.866 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.1 p -99.54 158.94 15.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 74.12 110.835 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.741 ' HB ' HD12 ' A' ' 35' ' ' LEU . 22.8 mm -140.95 139.75 33.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.153 -0.476 . . . . 74.12 111.17 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.7 mtm -145.87 131.82 19.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 73.23 110.902 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 44.0 m-20 -84.06 -169.78 2.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 64.13 110.857 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.19 -58.24 8.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 53.33 110.873 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.1 -55.8 24.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.191 -0.459 . . . . 74.32 110.867 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.47 -58.97 4.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 70.33 110.87 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.3 t -55.42 -38.41 68.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.15 -0.477 . . . . 71.31 110.826 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.09 -45.81 89.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 72.14 110.821 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.3 -58.12 6.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 63.45 111.159 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -54.02 -46.88 71.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 75.51 110.892 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.411 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -64.67 -50.52 66.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.125 -0.489 . . . . 72.25 110.883 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.39 -39.63 57.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.255 -0.43 . . . . 62.54 111.128 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.754 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.4 mt-30 -71.94 -67.56 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.248 -0.433 . . . . 50.13 110.847 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.467 HG23 ' N ' ' A' ' 58' ' ' LYS . 21.9 m -46.77 -41.88 5.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 74.13 111.148 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.467 ' N ' HG23 ' A' ' 57' ' ' VAL . 10.0 mmmm -65.94 -50.83 62.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.246 -0.433 . . . . 73.22 110.89 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.43 -52.28 39.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 72.22 111.128 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.611 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -66.45 -42.67 87.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 72.14 110.869 -179.9 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 31.4 mtp85 -50.09 -52.98 30.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.154 -0.475 . . . . 72.02 110.892 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.26 -53.79 32.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 75.13 111.138 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.0 -39.48 26.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.293 -0.412 . . . . 54.3 110.813 -179.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 60' ' ' PHE . 60.3 t -80.7 -28.13 11.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 72.4 111.088 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -19.58 48.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.45 . . . . 74.22 110.877 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.35 -23.35 36.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.191 -0.459 . . . . 75.05 111.099 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -51.78 -74.85 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 75.41 110.871 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.791 HG22 HG13 ' A' ' 69' ' ' VAL . 92.9 m -118.52 -75.63 0.58 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 74.54 111.154 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.791 HG13 HG22 ' A' ' 68' ' ' THR . 16.5 m -149.2 -172.37 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 73.32 111.128 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.559 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -105.57 159.75 28.43 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.653 0.74 . . . . 43.12 111.162 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.559 ' HD2' ' HB1' ' A' ' 70' ' ' ALA . 53.3 Cg_endo -69.76 -8.12 22.8 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.699 2.266 . . . . 72.52 112.356 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -97.69 -35.33 10.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 71.53 110.853 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -57.43 -60.02 4.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.135 -0.484 . . . . 71.33 110.874 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.895 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -45.74 -68.41 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.18 -0.463 . . . . 74.21 111.124 -179.965 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -48.2 -39.51 9.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.435 . . . . 71.12 111.166 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -60.18 -47.51 85.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.438 . . . . 74.41 110.875 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.562 HG22 ' HB2' ' A' ' 121' ' ' ASP . 95.0 t -60.49 -38.82 79.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 74.5 111.168 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.528 HH22 HG21 ' A' ' 113' ' ' THR . 0.4 OUTLIER -63.66 -60.05 3.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 54.24 110.939 -179.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.31 -21.22 66.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.475 . . . . 74.11 110.899 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -70.32 -54.2 13.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.267 -0.424 . . . . 71.23 110.918 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.816 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.1 mt -91.29 14.84 13.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 64.35 110.931 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 30.5 m 53.89 37.52 26.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.159 -0.473 . . . . 54.04 110.869 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.816 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.8 mm? -79.69 83.82 5.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 70.21 110.912 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.604 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.19 157.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 63.52 111.137 179.906 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -56.45 -23.13 36.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.219 -0.446 . . . . 75.24 110.885 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.63 -48.54 13.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 73.01 110.916 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.604 ' H ' HG23 ' A' ' 84' ' ' THR . 43.4 tt0 -61.63 -55.72 27.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.218 -0.447 . . . . 64.1 110.892 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.428 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -49.15 -32.45 10.1 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.184 -0.462 . . . . 73.15 111.087 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 5.6 p -80.54 -35.19 34.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 62.4 110.86 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -73.09 -23.7 60.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.084 -0.507 . . . . 63.23 110.846 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.77 HG23 ' HB3' ' A' ' 131' ' ' ARG . 19.3 mm -105.19 -63.02 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 61.13 111.09 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.576 ' HB3' HG23 ' A' ' 113' ' ' THR . 3.8 m-85 -74.62 -64.36 1.05 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.228 -0.442 . . . . 75.43 110.911 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 116.78 47.56 0.48 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.706 -0.759 . . . . 44.31 112.459 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -67.42 -35.34 87.01 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.768 -0.73 . . . . 41.52 112.443 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.31 -119.4 5.67 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.756 -0.735 . . . . 71.53 112.541 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 97' ' ' ASN . 0.1 OUTLIER -120.46 -61.57 2.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.859 0.362 . . . . 62.22 111.056 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.48 ' N ' HG22 ' A' ' 96' ' ' VAL . 1.0 OUTLIER -86.15 43.97 1.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.198 -0.455 . . . . 71.14 110.912 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -60.29 -75.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.144 -0.48 . . . . 55.14 111.125 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -41.81 -39.88 1.89 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 75.24 110.837 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.2 m -59.95 -76.22 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.116 -0.493 . . . . 74.31 110.836 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.622 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 30.1 mtt180 -50.34 -44.66 54.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 64.23 110.884 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.725 ' HB3' HD12 ' A' ' 74' ' ' ILE . 8.2 m-85 -55.86 -37.21 68.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 64.35 110.937 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -51.8 -29.26 18.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.1 -0.5 . . . . 74.53 110.867 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -107.16 -22.25 12.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 61.22 110.922 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.39 27.0 9.53 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.664 -0.779 . . . . 73.05 112.462 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 -98.34 -6.64 30.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.842 0.353 . . . . 71.23 110.843 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.622 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -110.51 10.57 23.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 22.02 111.123 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.45 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.0 OUTLIER -124.19 57.2 13.02 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.579 0.704 . . . . 71.14 110.91 -179.895 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.523 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.9 Cg_endo -69.74 35.87 0.22 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.635 2.223 . . . . 64.45 112.408 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.762 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER 73.67 32.56 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.634 0.731 . . . . 74.34 110.894 179.934 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.762 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.0 Cg_endo -69.72 -164.02 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.721 2.28 . . . . 74.13 112.351 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.32 -30.95 21.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.473 . . . . 63.14 110.852 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.739 HG22 ' CD1' ' A' ' 117' ' ' LEU . 74.7 m -53.48 -48.08 69.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 73.42 111.101 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.694 HG21 ' CG2' ' A' ' 68' ' ' THR . 40.2 mm -55.19 -46.27 77.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.45 . . . . 62.53 111.189 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.505 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -63.39 -29.14 70.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.149 -0.478 . . . . 73.22 110.894 179.831 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.549 ' CD2' HD12 ' A' ' 130' ' ' ILE . 6.4 mp -79.69 -42.45 24.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.203 -0.453 . . . . 74.04 110.862 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.895 HD13 HG22 ' A' ' 74' ' ' ILE . 3.8 mt -61.19 -49.71 76.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.451 . . . . 65.23 110.863 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.558 ' HG3' HG13 ' A' ' 119' ' ' VAL . 16.3 ptp180 -52.85 -37.22 59.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 60.54 110.859 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.558 HG13 ' HG3' ' A' ' 118' ' ' ARG . 32.8 m -90.87 -11.35 9.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.222 -0.445 . . . . 73.22 111.108 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.743 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -81.71 -40.23 23.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 72.21 110.912 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.562 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.5 OUTLIER -50.44 -30.23 12.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 72.41 110.872 179.864 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -98.09 -19.26 18.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 73.22 110.876 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.743 ' O ' HD13 ' A' ' 120' ' ' LEU . 57.1 m-70 -129.64 88.89 48.35 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.607 0.718 . . . . 61.53 110.917 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.692 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.7 Cg_endo -69.75 2.17 3.77 Favored 'Trans proline' 0 N--CA 1.466 -0.13 0 C-N-CA 122.68 2.253 . . . . 63.34 112.351 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -115.75 -12.59 11.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 74.54 110.872 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.658 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.7 tp -54.26 -46.46 72.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 71.22 110.892 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.442 ' HB3' HD11 ' A' ' 120' ' ' LEU . 0.9 OUTLIER -48.61 -30.62 5.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.165 -0.47 . . . . 64.0 110.896 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.464 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.2 m-80 -85.19 -31.06 23.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 73.41 110.889 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.424 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.9 OUTLIER -89.75 4.41 49.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 71.44 110.86 -179.948 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.658 HG23 ' O ' ' A' ' 126' ' ' LEU . 12.8 pt -123.63 -34.84 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.477 . . . . 75.14 111.157 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.77 ' HB3' HG23 ' A' ' 91' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 65.42 110.873 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.446 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.85 0.357 . . . . 71.03 110.895 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.43 -169.71 0.46 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.261 -0.427 . . . . 75.44 110.871 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.417 ' O ' ' N ' ' A' ' 7' ' ' HIS . 1.9 p 176.7 59.42 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.61 0.719 . . . . 43.34 110.937 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.7 1.74 4.13 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.664 2.242 . . . . 71.42 112.371 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.596 HG21 ' CD ' ' A' ' 42' ' ' GLU . 22.8 m -92.93 -37.35 8.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 73.21 111.148 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -127.0 -33.52 2.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 61.32 110.878 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.417 ' N ' ' O ' ' A' ' 3' ' ' CYS . 15.9 m-70 66.6 57.56 0.68 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.23 -0.441 . . . . 72.33 110.84 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -123.49 -75.78 0.6 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.278 -0.419 . . . . 75.22 110.869 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.56 -116.05 3.02 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.783 -0.722 . . . . 52.11 112.484 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.446 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 8.0 pt-20 -176.65 94.82 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.768 0.318 . . . . 70.42 110.929 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.597 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.3 ptp -54.62 106.19 0.2 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.208 -0.451 . . . . 75.52 110.809 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.442 HG12 ' O ' ' A' ' 10' ' ' GLU . 4.2 p -143.27 124.44 10.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 64.13 111.128 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.614 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.1 p -48.75 132.05 17.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 73.31 110.897 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.409 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . 176.98 81.93 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.763 -0.732 . . . . 74.04 112.516 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.414 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -36.88 146.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.848 0.356 . . . . 74.44 111.154 -179.933 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.86 -165.51 1.65 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.183 -0.462 . . . . 73.34 110.94 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.682 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -95.19 116.76 29.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 75.12 110.871 179.841 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.718 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.1 mm -107.52 92.89 9.07 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.687 0.756 . . . . 71.03 111.112 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.411 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.4 Cg_endo -69.85 97.1 0.63 Allowed 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.651 2.234 . . . . 61.1 112.343 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.432 ' HB3' HG23 ' A' ' 27' ' ' THR . 18.5 t80 -62.94 -38.54 91.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 63.41 110.899 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.478 HG21 ' HG2' ' A' ' 25' ' ' ARG . 17.0 m -128.91 144.53 51.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 61.12 111.167 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -133.89 43.43 2.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.282 -0.417 . . . . 73.4 110.916 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.47 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -129.28 -68.38 0.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.154 -0.476 . . . . 71.45 110.884 -179.907 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -136.53 -46.04 0.08 OUTLIER Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.674 -0.774 . . . . 64.21 112.47 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.478 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -94.32 39.77 1.09 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.857 0.361 . . . . 74.32 110.885 -179.895 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.401 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 12.7 tttt -52.32 115.42 1.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 73.32 110.931 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.432 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -129.06 93.32 3.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.261 -0.427 . . . . 73.42 111.13 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.682 HG11 ' HB2' ' A' ' 17' ' ' ASP . 46.4 t -76.63 127.53 37.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.449 . . . . 73.31 111.117 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.741 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.71 51.22 2.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 62.31 110.95 179.945 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.2 mttp -37.74 107.64 0.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 71.22 110.88 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.67 47.46 0.4 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.791 -0.718 . . . . 72.21 112.497 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.58 HD11 ' HB3' ' A' ' 29' ' ' LEU . 16.7 mm -107.93 92.12 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.799 0.333 . . . . 61.5 111.2 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.05 154.07 38.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.456 . . . . 61.35 110.868 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.25 -107.8 0.29 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.708 -0.758 . . . . 52.54 112.493 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.757 HD12 ' HB ' ' A' ' 44' ' ' ILE . 45.1 mt -156.99 87.23 0.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.743 0.306 . . . . 71.4 110.856 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.434 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -162.62 159.47 24.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.195 -0.457 . . . . 74.14 110.929 179.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 36.1 t -168.56 -38.86 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.078 -0.51 . . . . 73.4 110.881 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.404 HG13 ' N ' ' A' ' 39' ' ' HIS . 2.5 p -124.05 -47.02 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 53.44 111.146 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.404 ' N ' HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -91.1 171.76 9.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 71.53 110.891 179.924 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.8 p -137.3 9.58 2.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 74.13 110.831 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -100.38 -62.67 1.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 54.2 110.926 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.596 ' CD ' HG21 ' A' ' 5' ' ' VAL . 13.4 tp10 -76.73 61.68 1.89 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 65.02 110.865 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.4 p -99.08 159.5 14.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 74.12 110.881 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.757 ' HB ' HD12 ' A' ' 35' ' ' LEU . 21.3 mm -143.85 140.06 25.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 74.12 111.121 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.7 mtt -143.27 135.11 26.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.439 . . . . 73.23 110.859 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -86.89 -169.5 2.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.187 -0.46 . . . . 64.13 110.921 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.83 -60.87 2.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.166 -0.47 . . . . 53.33 110.961 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -52.29 -57.07 10.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 74.32 110.843 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -50.84 -58.98 4.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 70.33 110.894 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.8 t -53.89 -40.97 67.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 71.31 110.865 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.93 -44.73 87.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.148 -0.478 . . . . 72.14 110.889 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.72 -60.45 3.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.456 . . . . 63.45 111.034 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.436 ' CZ ' HG11 ' A' ' 57' ' ' VAL . 20.6 t80 -53.56 -47.51 69.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 75.51 110.936 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.43 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -62.75 -48.36 79.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 72.25 110.874 179.925 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.45 -42.9 64.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 62.54 111.01 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.741 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.6 mt-30 -69.55 -66.16 0.62 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 50.13 110.968 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.436 HG11 ' CZ ' ' A' ' 53' ' ' PHE . 17.9 m -47.3 -35.94 3.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.241 -0.436 . . . . 74.13 111.083 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 mmmt -69.79 -51.32 34.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.201 -0.454 . . . . 73.22 110.865 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.97 -52.04 53.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.447 . . . . 72.22 111.163 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.635 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.2 OUTLIER -65.41 -46.1 81.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 72.14 110.863 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.93 -52.39 33.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.107 -0.497 . . . . 72.02 110.85 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.87 -54.41 35.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 75.13 111.119 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.06 -41.19 34.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.221 -0.445 . . . . 54.3 110.867 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 60' ' ' PHE . 41.9 t -78.86 -27.15 13.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.081 -0.509 . . . . 72.4 111.096 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.2 -19.24 62.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 74.22 110.915 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.84 -20.05 66.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.501 . . . . 75.05 111.119 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -58.7 172.49 0.51 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 75.41 110.912 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.931 HG22 HG13 ' A' ' 69' ' ' VAL . 99.2 m -51.77 -77.38 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.143 -0.481 . . . . 74.54 111.14 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.931 HG13 HG22 ' A' ' 68' ' ' THR . 19.1 m -137.77 -174.01 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 73.32 111.127 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.509 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -104.22 158.18 32.47 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.639 0.733 . . . . 43.12 111.091 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.564 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.6 Cg_endo -69.7 -7.46 21.09 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.668 2.245 . . . . 72.52 112.377 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -96.43 -39.1 9.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.158 -0.473 . . . . 71.53 110.943 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.429 ' CE1' ' HA ' ' A' ' 118' ' ' ARG . 11.8 t80 -55.31 -60.2 3.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.106 -0.497 . . . . 71.33 110.854 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.623 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -45.67 -69.72 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 74.21 111.15 -179.999 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 30.1 m -47.76 -38.01 6.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.129 -0.487 . . . . 71.12 111.151 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.1 mtmt -61.47 -45.79 92.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 74.41 110.886 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.626 HG22 ' HB2' ' A' ' 121' ' ' ASP . 69.5 t -61.93 -38.33 80.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 74.5 111.091 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.438 HH22 HG21 ' A' ' 113' ' ' THR . 0.3 OUTLIER -65.25 -56.61 11.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.28 -0.418 . . . . 54.24 110.822 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.6 pttt -67.17 -21.24 65.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.253 -0.431 . . . . 74.11 110.912 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -71.39 -53.24 14.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 71.23 110.871 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.836 ' HB2' HD23 ' A' ' 83' ' ' LEU . 14.1 mt -91.63 14.99 13.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.238 -0.437 . . . . 64.35 110.943 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.3 m 51.54 38.18 21.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 54.04 110.85 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.836 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.9 mm? -79.28 86.75 5.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 70.21 110.827 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.645 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.18 155.92 0.18 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 63.52 111.097 179.905 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -58.34 -21.65 50.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.173 -0.467 . . . . 75.24 110.91 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -80.68 -53.72 6.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 73.01 110.855 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.645 ' H ' HG23 ' A' ' 84' ' ' THR . 0.5 OUTLIER -63.08 -47.69 81.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 64.1 110.881 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.414 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -56.5 -32.53 65.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.119 -0.491 . . . . 73.15 111.028 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 26.3 p -80.57 -33.98 35.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.305 -0.407 . . . . 62.4 110.808 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -74.3 -25.7 59.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 63.23 110.881 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.726 ' CD1' HD12 ' A' ' 127' ' ' LEU . 49.7 mt -101.43 -59.76 3.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 61.13 111.132 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.551 ' HB3' HG23 ' A' ' 113' ' ' THR . 6.7 m-85 -77.99 -62.86 1.54 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 75.43 110.86 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 111.98 50.39 0.59 Allowed Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.77 -0.728 . . . . 44.31 112.538 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -82.12 -44.61 7.49 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.772 -0.728 . . . . 41.52 112.525 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 109.96 167.33 19.82 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.724 -0.75 . . . . 71.53 112.461 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.502 HG13 ' N ' ' A' ' 97' ' ' ASN . 3.4 p -56.67 -50.62 73.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.845 0.355 . . . . 62.22 111.124 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.502 ' N ' HG13 ' A' ' 96' ' ' VAL . 12.0 p30 -86.18 33.99 0.62 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 71.14 110.934 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.407 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -64.26 -77.17 0.06 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 55.14 111.114 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.407 ' C ' ' O ' ' A' ' 98' ' ' ALA . 47.9 m-85 -37.75 -47.11 0.97 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 75.24 110.854 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.08 -75.39 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.149 -0.478 . . . . 74.31 110.916 -179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.548 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 17.2 mtt180 -46.82 -53.64 11.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.093 -0.503 . . . . 64.23 110.865 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.622 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.7 m-85 -49.6 -39.41 35.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 64.35 110.929 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -51.81 -40.55 60.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.114 -0.494 . . . . 74.53 110.913 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.18 -18.8 22.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.111 -0.495 . . . . 61.22 110.942 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.33 25.88 13.22 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.726 -0.749 . . . . 73.05 112.492 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -92.82 -28.65 16.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.847 0.356 . . . . 71.23 110.926 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.548 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -98.13 18.86 15.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 22.02 111.083 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.498 ' C ' ' H ' ' A' ' 110' ' ' HIS . 0.9 OUTLIER -121.01 53.87 3.65 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.607 0.718 . . . . 71.14 110.913 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.5 Cg_endo -69.75 27.06 0.18 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.652 2.235 . . . . 64.45 112.374 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.731 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 3.0 m170 70.87 36.02 0.1 Allowed Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 121.649 0.738 . . . . 74.34 110.919 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.731 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.3 Cg_endo -69.74 -165.28 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.608 2.205 . . . . 74.13 112.363 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 12.9 p -82.56 -32.72 28.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 63.14 110.882 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.551 HG23 ' HB3' ' A' ' 92' ' ' PHE . 17.3 m -49.02 -42.73 39.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 73.42 111.068 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.442 HD11 ' HG2' ' A' ' 108' ' ' GLN . 24.4 mm -60.76 -43.5 95.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.253 -0.431 . . . . 62.53 111.13 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.695 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -63.33 -29.67 70.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 73.22 110.929 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.695 HD12 ' HG3' ' A' ' 115' ' ' LYS . 8.1 mp -81.49 -47.61 12.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.236 -0.438 . . . . 74.04 110.9 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.623 HD13 HG22 ' A' ' 74' ' ' ILE . 34.9 mt -56.39 -47.81 78.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.448 . . . . 65.23 110.926 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.66 ' HG3' HG13 ' A' ' 119' ' ' VAL . 15.3 ptp180 -55.18 -36.09 65.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 60.54 110.815 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.66 HG13 ' HG3' ' A' ' 118' ' ' ARG . 19.9 m -95.91 0.22 10.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.287 -0.415 . . . . 73.22 111.15 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.754 HD12 HD13 ' A' ' 81' ' ' LEU . 0.5 OUTLIER -92.21 -38.29 12.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.105 -0.498 . . . . 72.21 110.915 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.626 ' HB2' HG22 ' A' ' 77' ' ' VAL . 0.3 OUTLIER -52.45 -24.4 7.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 72.41 110.844 179.841 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.502 ' HD3' ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -100.66 -20.37 15.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.244 -0.434 . . . . 73.22 110.942 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.732 ' O ' HD13 ' A' ' 120' ' ' LEU . 51.0 m-70 -130.19 91.05 40.11 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.547 0.689 . . . . 61.53 110.935 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.673 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.8 Cg_endo -69.69 2.05 3.84 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.658 2.238 . . . . 63.34 112.326 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -116.45 -12.17 11.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.439 . . . . 74.54 110.924 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.653 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.8 tp -52.9 -47.4 67.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 71.22 110.955 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.726 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.8 pt? -49.7 -29.52 7.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.132 -0.485 . . . . 64.0 110.901 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.493 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 5.2 m-80 -86.08 -28.41 24.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.46 . . . . 73.41 110.855 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.433 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -93.71 5.36 51.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 71.44 110.936 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.653 HG23 ' O ' ' A' ' 126' ' ' LEU . 11.4 pt -124.8 -35.18 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 75.14 111.145 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.493 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.6 ptt-85 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 65.42 110.859 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mmt . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.817 0.341 . . . . 71.03 110.852 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.34 -169.14 0.43 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 75.44 110.926 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.0 p -179.83 59.7 0.1 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.611 0.72 . . . . 43.34 110.925 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -4.51 14.18 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.684 2.256 . . . . 71.42 112.332 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.543 HG12 ' N ' ' A' ' 6' ' ' CYS . 2.1 t -74.43 -62.17 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 73.21 111.14 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.543 ' N ' HG12 ' A' ' 5' ' ' VAL . 49.4 t -120.14 -18.58 8.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 61.32 110.861 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 63.65 79.88 0.25 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.252 -0.431 . . . . 72.33 110.848 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -138.52 -75.49 0.38 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 75.22 110.952 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.636 ' HA3' HG13 ' A' ' 38' ' ' VAL . . . -98.05 -114.27 3.32 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.678 -0.773 . . . . 52.11 112.481 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.46 ' HG2' HG11 ' A' ' 38' ' ' VAL . 5.7 pt-20 -170.62 93.94 0.2 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.801 0.334 . . . . 70.42 110.945 -179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.564 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 0.7 OUTLIER -54.18 98.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 75.52 110.874 -179.934 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 15.0 p -144.32 131.02 16.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 64.13 111.087 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.515 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.3 OUTLIER -44.91 122.75 3.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 73.31 110.831 -179.875 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.76 81.58 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.713 -0.756 . . . . 74.04 112.509 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.418 ' N ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.89 148.38 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.862 0.363 . . . . 74.44 111.153 -179.98 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.42 -165.95 1.8 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 73.34 110.939 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.688 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -96.81 116.98 30.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 75.12 110.859 179.833 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.725 ' O ' HD22 ' A' ' 29' ' ' LEU . 9.9 mm -107.74 91.78 7.91 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.548 0.689 . . . . 71.03 111.096 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.455 ' HA ' HG22 ' A' ' 28' ' ' VAL . 54.0 Cg_endo -69.77 96.29 0.59 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.658 2.239 . . . . 61.1 112.359 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.441 ' HB3' HG23 ' A' ' 27' ' ' THR . 16.5 t80 -63.32 -37.6 87.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 63.41 110.956 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.504 HG21 ' HG2' ' A' ' 25' ' ' ARG . 16.4 m -128.78 147.22 50.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.111 -0.495 . . . . 61.12 111.204 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -144.19 37.22 1.25 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 73.4 110.867 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.455 ' HD3' HG23 ' A' ' 21' ' ' THR . 0.0 OUTLIER -128.01 -39.74 1.73 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.193 -0.458 . . . . 71.45 110.897 -179.892 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -156.76 -58.82 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.67 -0.776 . . . . 64.21 112.441 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.504 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -90.92 46.77 1.35 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.869 0.366 . . . . 74.32 110.888 -179.836 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.417 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 10.8 tttm -53.74 116.31 2.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 73.32 110.923 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.441 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -131.58 92.2 3.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.305 -0.407 . . . . 73.42 111.186 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.688 HG11 ' HB2' ' A' ' 17' ' ' ASP . 42.8 t -76.61 127.55 37.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 73.31 111.127 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.74 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.79 51.51 2.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 62.31 110.893 179.934 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 20.2 mttp -38.99 107.33 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.215 -0.448 . . . . 71.22 110.888 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.67 44.91 0.4 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.75 -0.738 . . . . 72.21 112.496 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.587 HG22 ' OH ' ' A' ' 36' ' ' TYR . 14.3 mm -105.58 90.09 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.885 0.374 . . . . 61.5 111.17 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -73.77 156.62 37.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 61.35 110.857 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.34 -106.65 0.27 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.784 -0.722 . . . . 52.54 112.507 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.762 HD12 ' HB ' ' A' ' 44' ' ' ILE . 65.2 mt -155.61 83.95 1.04 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.781 0.324 . . . . 71.4 110.899 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.587 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -169.99 149.66 3.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.257 -0.429 . . . . 74.14 110.972 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.2 t -167.47 25.74 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.109 -0.496 . . . . 73.4 110.859 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.636 HG13 ' HA3' ' A' ' 9' ' ' GLY . 1.9 p 179.29 -34.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 53.44 111.138 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -113.79 176.2 5.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.195 -0.457 . . . . 71.53 110.795 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.58 24.57 1.38 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.485 . . . . 74.13 110.877 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -100.82 -77.42 0.54 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 54.2 110.895 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -78.28 60.75 2.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.475 . . . . 65.02 110.892 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.0 p -87.9 162.77 16.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 74.12 110.892 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.762 ' HB ' HD12 ' A' ' 35' ' ' LEU . 21.1 mm -146.99 139.3 19.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 74.12 111.044 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.2 mtt -142.67 146.02 34.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 73.23 110.869 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.5 m-20 -95.56 -169.09 1.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.158 -0.473 . . . . 64.13 110.88 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -55.12 -60.53 3.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 53.33 110.886 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -52.67 -57.95 8.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.436 . . . . 74.32 110.877 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.53 -59.35 4.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 70.33 110.834 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.6 t -52.82 -42.39 65.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.187 -0.46 . . . . 71.31 110.815 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.25 -44.34 83.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.129 -0.487 . . . . 72.14 110.899 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.89 -61.76 1.97 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 63.45 111.157 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.437 ' O ' HG13 ' A' ' 57' ' ' VAL . 17.8 t80 -52.44 -46.87 66.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.25 -0.432 . . . . 75.51 110.855 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.449 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.34 -49.57 73.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 72.25 110.889 179.935 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.49 -42.12 61.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 62.54 111.035 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.74 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.5 mt-30 -70.32 -66.9 0.54 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.272 -0.422 . . . . 50.13 110.961 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.449 HG22 ' HA ' ' A' ' 54' ' ' MET . 16.6 m -46.95 -35.64 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.449 . . . . 74.13 111.109 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.8 mmmm -70.42 -51.95 25.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 73.22 110.912 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.26 -51.49 53.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.277 -0.42 . . . . 72.22 111.143 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.613 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -66.41 -45.81 78.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 72.14 110.935 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.35 -46.86 56.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 72.02 110.863 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.21 -57.52 5.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 75.13 111.078 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.26 -39.2 13.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 54.3 110.85 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 60' ' ' PHE . 46.0 t -80.59 -31.28 12.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 72.4 111.126 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -48.46 -32.45 7.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 74.22 110.928 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.11 -45.92 89.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.158 -0.474 . . . . 75.05 111.16 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 47.01 -164.79 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 75.41 110.815 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.965 HG22 HG13 ' A' ' 69' ' ' VAL . 98.2 m -97.44 -75.85 0.53 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.07 -0.514 . . . . 74.54 111.133 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.965 HG13 HG22 ' A' ' 68' ' ' THR . 4.7 m -128.35 -168.16 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 73.32 111.095 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.469 ' HB1' ' HD2' ' A' ' 71' ' ' PRO . . . -92.83 157.49 39.42 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.509 0.671 . . . . 43.12 111.077 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.712 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.6 Cg_endo -69.76 -6.33 18.35 Favored 'Trans proline' 0 C--N 1.34 0.121 0 C-N-CA 122.669 2.246 . . . . 72.52 112.35 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -92.45 -44.6 8.58 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.23 -0.441 . . . . 71.53 110.834 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -52.9 -62.22 1.79 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 71.33 110.904 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.712 HD11 ' HA ' ' A' ' 71' ' ' PRO . 0.3 OUTLIER -44.63 -69.97 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.142 -0.481 . . . . 74.21 111.095 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 26.7 m -48.28 -39.17 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.175 -0.466 . . . . 71.12 111.12 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -59.68 -47.21 86.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 74.41 110.898 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.413 HG22 ' HB2' ' A' ' 121' ' ' ASP . 98.7 t -60.29 -39.4 80.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 74.5 111.146 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.577 HH22 HG21 ' A' ' 113' ' ' THR . 0.7 OUTLIER -64.06 -60.39 3.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 54.24 110.793 -179.875 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -63.89 -22.72 67.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.257 -0.429 . . . . 74.11 110.864 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 14.2 ttmm -68.18 -54.71 15.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.462 . . . . 71.23 110.904 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.847 ' HB2' HD23 ' A' ' 83' ' ' LEU . 9.2 mt -91.6 15.91 11.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.241 -0.436 . . . . 64.35 110.902 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.88 39.53 26.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 54.04 110.811 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.847 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.5 mm? -79.34 86.15 5.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.144 -0.48 . . . . 70.21 110.937 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.645 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -44.95 156.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.247 -0.433 . . . . 63.52 111.109 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -59.04 -20.6 54.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 75.24 110.951 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -81.35 -53.69 6.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 73.01 110.909 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.645 ' H ' HG23 ' A' ' 84' ' ' THR . 4.0 tt0 -59.57 -48.66 80.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.47 . . . . 64.1 110.81 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.45 ' HB1' ' HD2' ' A' ' 92' ' ' PHE . . . -56.12 -32.87 64.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.178 -0.465 . . . . 73.15 111.11 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 28.6 t -79.42 -31.63 42.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 62.4 110.828 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -79.47 -24.24 42.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 63.23 110.894 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.727 ' CD1' HD12 ' A' ' 127' ' ' LEU . 50.7 mt -103.61 -62.07 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.481 . . . . 61.13 111.158 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.541 ' HB3' HG23 ' A' ' 113' ' ' THR . 5.7 m-85 -75.31 -64.16 1.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.173 -0.467 . . . . 75.43 110.85 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 116.73 49.33 0.43 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.718 -0.753 . . . . 44.31 112.519 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -82.95 -45.39 6.7 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.701 -0.761 . . . . 41.52 112.434 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.403 ' O ' ' HB2' ' A' ' 98' ' ' ALA . . . 109.66 166.89 20.05 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.762 -0.733 . . . . 71.53 112.489 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.5 HG13 ' N ' ' A' ' 97' ' ' ASN . 2.7 p -50.91 -51.69 19.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.827 0.346 . . . . 62.22 111.096 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.5 ' N ' HG13 ' A' ' 96' ' ' VAL . 28.2 m-20 -87.23 40.21 0.91 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 71.14 110.886 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.404 ' O ' ' C ' ' A' ' 99' ' ' PHE . . . -63.86 -78.22 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.226 -0.443 . . . . 55.14 111.073 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.404 ' C ' ' O ' ' A' ' 98' ' ' ALA . 40.6 m-85 -38.2 -42.55 0.69 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.165 -0.471 . . . . 75.24 110.932 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.0 t -60.02 -74.81 0.07 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.181 -0.463 . . . . 74.31 110.851 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.518 ' CB ' ' HB2' ' A' ' 107' ' ' ALA . 34.6 mtt85 -49.64 -46.8 49.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.164 -0.471 . . . . 64.23 110.931 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -56.63 -35.47 68.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.149 -0.478 . . . . 64.35 110.886 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -77.86 -3.77 43.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 74.53 110.894 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.2 -19.1 10.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 61.22 110.927 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.84 19.83 35.79 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.703 -0.761 . . . . 73.05 112.495 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.1 m-20 -98.39 -29.51 13.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.764 0.316 . . . . 71.23 110.826 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.518 ' HB2' ' CB ' ' A' ' 101' ' ' ARG . . . -99.16 26.05 6.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 22.02 111.063 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.574 HE22 HG22 ' A' ' 69' ' ' VAL . 0.0 OUTLIER -126.37 47.51 2.44 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.606 0.717 . . . . 71.14 110.937 -179.982 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.553 ' CD ' ' N ' ' A' ' 108' ' ' GLN . 53.4 Cg_endo -69.7 24.94 0.17 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.669 2.246 . . . . 64.45 112.333 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.736 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 15.2 t-160 69.98 35.15 0.1 OUTLIER Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.586 0.707 . . . . 74.34 110.857 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.736 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 53.2 Cg_endo -69.82 -165.31 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.711 2.274 . . . . 74.13 112.259 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.5 t -79.84 -29.86 40.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.161 -0.472 . . . . 63.14 110.882 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.577 HG21 HH22 ' A' ' 78' ' ' ARG . 39.7 m -52.41 -39.25 60.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.161 -0.472 . . . . 73.42 111.184 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.894 HG21 HG21 ' A' ' 68' ' ' THR . 33.1 mm -63.45 -44.3 98.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.456 . . . . 62.53 111.138 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.708 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -65.16 -29.16 69.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.128 -0.487 . . . . 73.22 110.858 179.871 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.708 HD12 ' HG3' ' A' ' 115' ' ' LYS . 8.1 mp -81.94 -44.93 16.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.277 -0.42 . . . . 74.04 110.916 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.503 ' CD1' HG22 ' A' ' 113' ' ' THR . 39.8 mt -59.59 -48.27 82.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.456 . . . . 65.23 110.856 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.598 ' HG3' HG13 ' A' ' 119' ' ' VAL . 14.3 ptp180 -54.11 -37.61 64.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.228 -0.442 . . . . 60.54 110.928 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.598 HG13 ' HG3' ' A' ' 118' ' ' ARG . 27.4 m -91.88 -8.6 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 73.22 111.095 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.739 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.5 OUTLIER -83.24 -40.06 20.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 72.21 110.917 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.413 ' HB2' HG22 ' A' ' 77' ' ' VAL . 12.5 t0 -49.72 -31.31 11.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 72.41 110.873 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.93 -19.69 17.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 73.22 110.908 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.739 ' O ' HD13 ' A' ' 120' ' ' LEU . 34.9 m-70 -127.76 87.03 56.88 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.591 0.71 . . . . 61.53 110.875 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.707 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.9 Cg_endo -69.8 3.37 2.83 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.703 2.269 . . . . 63.34 112.35 180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -116.97 -12.7 10.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 74.54 110.92 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.663 ' O ' HG23 ' A' ' 130' ' ' ILE . 5.1 tp -53.97 -46.68 71.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.466 . . . . 71.22 110.941 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.727 HD12 ' CD1' ' A' ' 91' ' ' ILE . 1.7 pt? -49.65 -29.43 7.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.459 . . . . 64.0 110.912 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.489 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 4.7 m-80 -86.56 -27.93 23.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 73.41 110.864 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.428 ' HG3' HG23 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -94.15 4.96 53.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 71.44 110.955 179.941 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 126' ' ' LEU . 11.7 pt -124.24 -35.01 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 75.14 111.139 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.489 ' HG2' ' HA ' ' A' ' 128' ' ' ASN . 1.4 ptt-85 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 65.42 110.922 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.613 ' H2 ' ' HB2' ' A' ' 10' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.849 0.357 . . . . 71.03 110.949 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.75 -170.39 0.48 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 75.44 110.905 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 p 178.99 56.96 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.555 0.693 . . . . 43.34 110.904 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.403 ' HA ' ' CD2' ' A' ' 7' ' ' HIS . 53.4 Cg_endo -69.73 7.28 1.02 Allowed 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.658 2.239 . . . . 71.42 112.381 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.5 m -102.27 -43.3 9.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 73.21 111.114 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.9 -31.92 4.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.192 -0.458 . . . . 61.32 110.915 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.403 ' CD2' ' HA ' ' A' ' 4' ' ' PRO . 4.0 m-70 63.5 49.06 3.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.148 -0.478 . . . . 72.33 110.859 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 72.6 mm-40 -117.13 -75.6 0.58 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 75.22 110.881 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -93.76 -117.14 2.71 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.728 -0.749 . . . . 52.11 112.561 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.613 ' HB2' ' H2 ' ' A' ' 1' ' ' MET . 8.0 pt-20 -174.08 93.27 0.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.857 0.36 . . . . 70.42 110.887 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.54 ' HB2' ' HB3' ' A' ' 35' ' ' LEU . 1.2 ptp -52.65 106.1 0.15 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 75.52 110.931 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.428 HG12 ' O ' ' A' ' 10' ' ' GLU . 7.5 p -147.41 127.81 5.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.238 -0.437 . . . . 64.13 111.176 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.574 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -45.38 127.45 7.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 73.31 110.864 -179.781 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.95 81.74 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.741 -0.742 . . . . 74.04 112.467 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.412 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -37.38 147.34 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.887 0.375 . . . . 74.44 111.12 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.32 -165.77 1.77 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 73.34 110.906 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.672 ' HB2' HG11 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -96.38 116.66 29.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 75.12 110.856 179.918 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.698 ' O ' HD22 ' A' ' 29' ' ' LEU . 10.0 mm -107.62 92.44 8.62 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.644 0.735 . . . . 71.03 111.138 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.434 ' HA ' HG22 ' A' ' 28' ' ' VAL . 53.9 Cg_endo -69.78 96.88 0.61 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.688 2.259 . . . . 61.1 112.345 179.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.505 ' HB3' HG23 ' A' ' 27' ' ' THR . 18.3 t80 -62.65 -38.45 90.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 63.41 110.93 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.521 HG21 ' HG2' ' A' ' 25' ' ' ARG . 16.8 m -129.04 145.38 51.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.071 -0.513 . . . . 61.12 111.125 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -135.48 46.51 2.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 73.4 110.886 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.423 ' H ' HG22 ' A' ' 21' ' ' THR . 0.0 OUTLIER -131.79 -68.39 0.64 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.163 -0.471 . . . . 71.45 110.908 -179.915 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -137.21 -42.71 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.718 -0.754 . . . . 64.21 112.463 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.521 ' HG2' HG21 ' A' ' 21' ' ' THR . 0.0 OUTLIER -98.03 39.4 1.23 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.852 0.358 . . . . 74.32 110.865 -179.883 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.407 ' HA ' ' HB ' ' A' ' 21' ' ' THR . 12.8 tttm -51.64 117.27 2.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.287 -0.415 . . . . 73.32 110.915 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.505 HG23 ' HB3' ' A' ' 20' ' ' TYR . 1.7 t -129.66 92.15 3.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.257 -0.429 . . . . 73.42 111.119 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.672 HG11 ' HB2' ' A' ' 17' ' ' ASP . 40.4 t -76.77 127.18 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 73.31 111.189 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.76 HD12 ' HB3' ' A' ' 56' ' ' GLN . 0.3 OUTLIER -84.83 51.92 2.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.474 . . . . 62.31 110.885 -179.993 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.1 mttm -39.14 106.94 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 71.22 110.899 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 120.91 45.3 0.38 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.795 -0.717 . . . . 72.21 112.498 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.575 HG22 ' OH ' ' A' ' 36' ' ' TYR . 14.4 mm -105.93 91.3 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.834 0.35 . . . . 61.5 111.195 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.85 158.59 33.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.246 -0.434 . . . . 61.35 110.848 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 163.11 -105.99 0.27 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.709 -0.758 . . . . 52.54 112.45 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.742 HD12 ' HB ' ' A' ' 44' ' ' ILE . 46.9 mt -156.67 83.4 0.96 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.789 0.328 . . . . 71.4 110.952 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.575 ' OH ' HG22 ' A' ' 32' ' ' ILE . 0.1 OUTLIER -168.96 169.44 9.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.204 -0.453 . . . . 74.14 110.906 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.51 -33.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.061 -0.518 . . . . 73.4 110.909 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 p -120.23 -45.76 2.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 53.44 111.098 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -99.4 178.44 4.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 71.53 110.821 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 24.1 p -148.88 29.95 0.81 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.206 -0.452 . . . . 74.13 110.887 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -104.52 -77.27 0.58 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.453 . . . . 54.2 110.865 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -77.55 59.95 2.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.504 . . . . 65.02 110.881 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.7 p -83.74 158.88 21.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 74.12 110.832 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.742 ' HB ' HD12 ' A' ' 35' ' ' LEU . 28.1 mm -144.34 140.81 24.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.1 -0.5 . . . . 74.12 111.08 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 13.9 mtt -144.76 142.38 29.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.136 -0.484 . . . . 73.23 110.834 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.0 m-20 -90.76 -172.96 3.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 64.13 110.894 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.52 -62.1 1.84 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.47 . . . . 53.33 110.932 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -51.05 -58.17 6.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.155 -0.475 . . . . 74.32 110.885 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -49.13 -59.12 3.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.216 -0.447 . . . . 70.33 110.861 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.9 t -53.46 -42.05 66.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 71.31 110.895 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.24 -44.1 83.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.136 -0.484 . . . . 72.14 110.867 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.33 -61.37 2.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 63.45 111.048 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.455 ' CZ ' HG11 ' A' ' 57' ' ' VAL . 19.4 t80 -52.83 -46.66 67.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 75.51 110.873 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.43 ' HA ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -63.55 -49.61 72.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.49 . . . . 72.25 110.853 180.0 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.61 -42.77 62.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.276 -0.42 . . . . 62.54 111.033 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.76 ' HB3' HD12 ' A' ' 29' ' ' LEU . 3.5 mt-30 -70.04 -66.79 0.55 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 50.13 110.879 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.455 HG11 ' CZ ' ' A' ' 53' ' ' PHE . 17.7 m -46.68 -35.63 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 74.13 111.134 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -70.56 -51.01 31.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.468 . . . . 73.22 110.857 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.74 -51.18 58.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.302 -0.408 . . . . 72.22 111.038 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.607 ' O ' HG23 ' A' ' 64' ' ' VAL . 0.3 OUTLIER -67.34 -45.09 77.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.25 -0.432 . . . . 72.14 110.894 -179.898 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 -50.63 -50.55 53.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.177 -0.465 . . . . 72.02 110.88 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.24 -56.26 12.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.452 . . . . 75.13 111.156 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -46.67 -42.99 17.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 54.3 110.892 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 60' ' ' PHE . 57.3 t -74.09 -34.33 38.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 72.4 111.146 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -48.2 -34.07 9.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.882 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -52.77 -48.13 67.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 75.05 111.098 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 40.95 -99.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.153 -0.476 . . . . 75.41 110.884 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.771 HG22 HG13 ' A' ' 69' ' ' VAL . 88.3 m -50.87 -75.7 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 74.54 111.159 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.771 HG13 HG22 ' A' ' 68' ' ' THR . 15.7 m -149.24 -175.6 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 73.32 111.145 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -102.99 154.14 37.77 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.601 0.715 . . . . 43.12 111.118 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.597 ' HA ' HD11 ' A' ' 74' ' ' ILE . 53.6 Cg_endo -69.74 -7.67 21.65 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.721 2.281 . . . . 72.52 112.31 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -95.98 -38.92 10.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 71.53 110.88 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.531 ' O ' HG23 ' A' ' 77' ' ' VAL . 12.3 t80 -56.23 -59.98 4.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.49 . . . . 71.33 110.9 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.775 HG22 HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -45.22 -68.79 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.104 -0.498 . . . . 74.21 111.16 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.6 m -48.75 -39.1 10.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 71.12 111.144 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -61.04 -38.19 85.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 74.41 110.875 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 73' ' ' PHE . 55.2 t -70.88 -37.15 67.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.247 -0.433 . . . . 74.5 111.163 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 78' ' ' ARG . 0.6 OUTLIER -70.81 -33.16 70.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 54.24 110.857 -179.94 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.37 -20.1 24.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.195 -0.457 . . . . 74.11 110.936 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.474 ' HG2' HD23 ' A' ' 81' ' ' LEU . 1.2 ttmm -76.19 -51.5 11.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 71.23 110.956 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.812 ' HB2' HD23 ' A' ' 83' ' ' LEU . 11.3 mt -89.89 13.56 14.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.237 -0.438 . . . . 64.35 110.914 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.24 42.16 28.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 54.04 110.953 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.812 HD23 ' HB2' ' A' ' 81' ' ' LEU . 1.4 mm? -78.73 85.03 4.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.041 -0.527 . . . . 70.21 110.904 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.632 HG23 ' H ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -46.22 156.66 0.15 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.124 -0.489 . . . . 63.52 111.086 179.947 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -57.64 -23.01 48.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 75.24 110.911 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.0 mttm -79.47 -53.29 7.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 73.01 110.904 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.632 ' H ' HG23 ' A' ' 84' ' ' THR . 3.0 tt0 -63.66 -53.72 47.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 64.1 110.905 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.559 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . . . -53.65 -36.31 61.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.087 -0.506 . . . . 73.15 111.147 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.7 t -79.01 -28.81 43.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 62.4 110.824 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -78.08 -29.56 49.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.108 -0.496 . . . . 63.23 110.885 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.77 HD12 ' HB3' ' A' ' 131' ' ' ARG . 18.3 mm -98.8 -58.24 3.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.096 -0.502 . . . . 61.13 111.18 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.547 ' HB3' HG23 ' A' ' 113' ' ' THR . 5.5 m-85 -77.11 -64.36 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 75.43 110.842 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 110.54 45.37 0.91 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.786 -0.721 . . . . 44.31 112.479 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.71 -45.04 93.95 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.67 -0.776 . . . . 41.52 112.513 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 108.04 172.23 21.75 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.72 -0.752 . . . . 71.53 112.464 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.675 HG13 ' H ' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -50.53 -66.52 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.873 0.368 . . . . 62.22 111.161 -179.992 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.675 ' H ' HG13 ' A' ' 96' ' ' VAL . 8.4 t30 -86.21 42.4 0.99 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.471 . . . . 71.14 110.945 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.41 -76.17 0.06 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.124 -0.489 . . . . 55.14 111.084 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -39.69 -39.49 0.77 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.433 . . . . 75.24 110.866 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.9 m -61.01 -76.31 0.05 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 74.31 110.89 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.607 ' HB3' ' HB2' ' A' ' 107' ' ' ALA . 29.0 mtt85 -50.04 -45.61 52.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 64.23 110.855 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.434 ' HB3' HD12 ' A' ' 74' ' ' ILE . 11.9 m-85 -57.6 -37.22 72.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 64.35 110.941 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -62.75 -16.92 59.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 74.53 110.86 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.94 -20.54 12.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.238 -0.437 . . . . 61.22 110.926 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.8 28.75 11.65 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.724 -0.75 . . . . 73.05 112.458 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -106.71 -8.55 16.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.846 0.355 . . . . 71.23 110.905 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.607 ' HB2' ' HB3' ' A' ' 101' ' ' ARG . . . -115.06 13.65 16.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 22.02 111.088 179.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.612 HE22 HG22 ' A' ' 69' ' ' VAL . 0.0 OUTLIER -126.48 55.72 14.75 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.618 0.723 . . . . 71.14 110.863 -179.899 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.502 ' N ' ' HD3' ' A' ' 111' ' ' PRO . 53.5 Cg_endo -69.78 36.54 0.23 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.661 2.241 . . . . 64.45 112.358 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.753 ' N ' ' CD ' ' A' ' 111' ' ' PRO . 1.0 OUTLIER 72.05 33.92 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.551 0.691 . . . . 74.34 110.828 179.917 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.753 ' CD ' ' N ' ' A' ' 110' ' ' HIS . 54.2 Cg_endo -69.7 -164.14 0.12 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.722 2.281 . . . . 74.13 112.364 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.35 -32.81 32.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 63.14 110.861 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.547 HG23 ' HB3' ' A' ' 92' ' ' PHE . 22.7 m -52.7 -54.09 38.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.158 -0.474 . . . . 73.42 111.18 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.467 HD11 ' HB2' ' A' ' 108' ' ' GLN . 46.4 mm -50.95 -45.24 28.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 62.53 111.165 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.484 ' HG3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -63.75 -29.51 70.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 73.22 110.89 179.867 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.484 HD12 ' HG3' ' A' ' 115' ' ' LYS . 6.3 mp -80.01 -49.86 11.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.199 -0.455 . . . . 74.04 110.917 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.775 HD13 HG22 ' A' ' 74' ' ' ILE . 20.6 mt -55.42 -47.97 75.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 65.23 110.91 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.682 ' HG3' HG13 ' A' ' 119' ' ' VAL . 17.3 ptp180 -55.18 -35.54 64.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 60.54 110.908 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.682 HG13 ' HG3' ' A' ' 118' ' ' ARG . 18.8 m -96.95 0.32 10.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 73.22 111.132 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.736 HD13 ' O ' ' A' ' 123' ' ' HIS . 0.7 OUTLIER -93.1 -36.52 12.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 72.21 110.878 179.95 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -53.03 -24.37 9.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.12 -0.491 . . . . 72.41 110.882 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.481 ' HD3' ' HA ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -99.7 -20.2 16.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 73.22 110.935 179.982 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.736 ' O ' HD13 ' A' ' 120' ' ' LEU . 74.4 m-70 -132.52 93.4 25.02 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.604 0.716 . . . . 61.53 110.934 179.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.605 ' HB3' HD22 ' A' ' 81' ' ' LEU . 53.7 Cg_endo -69.77 -0.02 6.32 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.7 2.267 . . . . 63.34 112.333 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -114.31 -11.34 12.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.259 -0.428 . . . . 74.54 110.902 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.682 ' O ' HG23 ' A' ' 130' ' ' ILE . 7.8 tp -53.27 -49.15 67.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.122 -0.49 . . . . 71.22 110.861 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.743 HD13 HD11 ' A' ' 83' ' ' LEU . 2.0 pt? -51.28 -28.86 13.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.276 -0.42 . . . . 64.0 110.863 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.487 ' HA ' ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -86.36 -27.11 24.46 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.216 -0.447 . . . . 73.41 110.844 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.402 ' HG3' HG23 ' A' ' 130' ' ' ILE . 1.1 pp20? -94.12 2.46 55.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.269 -0.423 . . . . 71.44 110.899 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.682 HG23 ' O ' ' A' ' 126' ' ' LEU . 13.3 pt -121.47 -34.26 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 75.14 111.176 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.77 ' HB3' HD12 ' A' ' 91' ' ' ILE . 2.5 ptt-85 . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.104 -0.498 . . . . 65.42 110.826 179.908 . . . . . . . . 1 1 . 1 stop_ save_